SCHEMBL599567

SCHEMBL599567

CC(C)(C)c1ccc2ccccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.48
CYP2A6 P11509 6/20 0.48
TDP1 Q9NUW8 2/20 0.48
ALDH1A1 P00352 3/20 0.47
NPC1 O15118 1/20 0.47
PLA2G1B P04054 1/20 0.47
NFKB1 P19838 1/20 0.47
CASP3 P42574 1/20 0.47
RAB9A P51151 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
CASR P41180 1/20 0.45
CYP1A2 P05177 3/20 0.44
HSD17B10 Q99714 2/20 0.44
HPGD P15428 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30222062 1.00 PTPN1 (0.48) PTPN1CYP2A6TDP1ALDH1A1NPC1
SCHEMBL29416694 0.93 ALDH1A1 (0.45) PTPN1CYP2A6TDP1ALDH1A1NPC1
SCHEMBL260748 0.93 ALDH1A1 (0.45) PTPN1CYP2A6TDP1ALDH1A1NPC1
Benzene SCHEMBL28086858 0.91 ALDH1A1 (0.44) PTPN1CYP2A6TDP1ALDH1A1NPC1
SCHEMBL30010382 0.89 ALDH1A1 (0.52) TDP1ALDH1A1NPC1PLA2G1BNFKB1
SCHEMBL348347 0.89 ALDH1A1 (0.52) TDP1ALDH1A1NPC1PLA2G1BNFKB1
SCHEMBL7521505 0.87 ALDH1A1 (0.50) PTPN1CYP2A6TDP1ALDH1A1NPC1
SCHEMBL30010643 0.87 ALDH1A1 (0.50) PTPN1CYP2A6TDP1ALDH1A1NPC1
SCHEMBL28105147 0.87 ALDH1A1 (0.50) TDP1ALDH1A1NPC1PLA2G1BNFKB1
SCHEMBL29209229 0.86 CYP2A6 (0.63) PTPN1CYP2A6TDP1ALDH1A1NPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 87 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105294385-A Method for preparing 2-methyl-6-tert-butyl naphthalene by alkylation of naphthalene DALIAN CHEMICAL PHYSICS INST 2016-02-03 CN claimed
EP-0338054-B1 CROSS COUPLING OF TITANIUM ORGANYLS MERCK PATENT GmbH (DE) 1992-12-30 EP claimed
US-4225747-A Submarine electric power cables containing naphthalene based liquids INDUSTRIE PIRELLI SOCIETA PER AZIONI (IT) 1980-09-30 US claimed
US-20240244952-A1 ORGANIC LIGHT-EMITTING DEVICE AND ORGANOMETALLIC COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2024-07-18 US disclosed
US-20240244858-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2024-07-18 US disclosed
US-20240224785-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2024-07-04 US disclosed
US-20240209208-A1 Isotropic Pitch Compositions from Aromatic Feedstocks, Methods of Making the Same, and Uses Thereof ExxonMobil Technology and Engineering Company (US) 2024-06-27 US disclosed
US-20240182788-A1 Mesophase Pitch Compositions from Aromatic Feedstocks, Methods of Making the Same, and Uses Thereof EXXONMOBIL CHEMICAL COMPANY (US) 2024-06-06 US disclosed
US-20240074300-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2024-02-29 US disclosed
US-20240067669-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2024-02-29 US disclosed
EP-4314202-A1 MESOPHASE PITCH COMPOSITIONS FROM AROMATIC FEEDSTOCKS, METHODS OF MAKING THE SAME, AND USES THEREOF ExxonMobil Chemical Patents Inc. (US) 2024-02-07 EP disclosed
US-5663403-A CATALYSTS FOR HYDROFORMYLATION OR SIDE REACTION REDUCTION OF OLEFINS MITSUBISHI CHEMICAL CORPORATION (JP) 1997-09-02 US disclosed
EP-0440250-B1 Method of preparing alkylnaphthalene compounds NIPPON CATALYTIC CHEM IND (JP) 1995-04-19 EP disclosed
US-5382735-A Catalytic reaction of alkene with naphthalene using heteropoly acid NIPPON SHOKUBAI KAGAKU KOGYO COMPANY, LIMITED (JP) 1995-01-17 US disclosed
EP-0338054-B1 CROSS COUPLING OF TITANIUM ORGANYLS MERCK PATENT GmbH (DE) 1992-12-30 EP disclosed
EP-0440250-A2 Method of preparing alkylnaphthalene compounds NIPPON SHOKUBAI CO., LTD. (JP) 1991-08-07 EP disclosed
EP-0338054-A1 CROSS COUPLING OF TITANIUM ORGANYLS MERCK PATENT GmbH (DE) 1989-10-25 EP disclosed
EP-0212480-A1 Process for the production of 6-acyl-2-alkyl-naphthalene RIEDEL-DE HAEN AKTIENGESELLSCHAFT (DE) 1987-03-04 EP disclosed
US-4530745-A Method for electrolyzing cerous sulfate KAWASAKI KASEI CHEMICALS LTD. (JP) 1985-07-23 US disclosed
US-3969196-A Process for the separation of mixtures of substances STUDIENGESELLSCHAFT KOHLE M.B.H. (DT) 1976-07-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240067669-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE C1S, CHRM1, C1R PTPN1 2889/4885CYP2A6 1378/4885TDP1 4181/4885
US-20240074300-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE C1S, C1R, CHRM1 PTPN1 3559/4885CYP2A6 2211/4885TDP1 4122/4885
US-20240244952-A1 ORGANIC LIGHT-EMITTING DEVICE AND ORGANOMETALLIC COMPOUND LEF1, OCIAD1, OXA1L PTPN1 4143/4885CYP2A6 1399/4885TDP1 1285/4885
US-20240224785-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE C1S, CHRM1, C5 PTPN1 2183/4885CYP2A6 643/4885TDP1 3639/4885
US-20240244858-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE CRY1, CRY2, C1S PTPN1 2613/4885CYP2A6 1318/4885TDP1 3326/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.