SCHEMBL668650

SCHEMBL668650

Cc1[c]c2c(C)cccc2cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 6/20 0.39
ALDH1A1 P00352 5/20 0.39
CYP1A2 P05177 7/20 0.39
TSHR P16473 4/20 0.35
HPGD P15428 3/20 0.35
HSD17B10 Q99714 3/20 0.35
CYP3A4 P08684 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
ACHE P22303 1/20 0.33
CYP1A1 P04798 1/20 0.32
CYP1B1 Q16678 1/20 0.32
TRPA1 O75762 2/20 0.30
CD44 P16070 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL18317608 0.76 CYP2A6 (0.46) CYP2A6ALDH1A1CYP1A2TSHRHPGD
SCHEMBL10978940 0.71 MAPT (0.32) CYP2A6ALDH1A1CYP1A2
SCHEMBL455151 0.70 ALDH1A1 (0.41) CYP2A6ALDH1A1CYP1A2TSHRHPGD
SCHEMBL819236 0.69 CYP1A2 (0.48) CYP2A6ALDH1A1CYP1A2TSHRHPGD
SCHEMBL821036 0.68 CYP1A2 (0.40) CYP2A6ALDH1A1CYP1A2TSHRHPGD
SCHEMBL65563 0.67 CYP2A6 (0.37) CYP2A6ALDH1A1CYP1A2TSHRHPGD
SCHEMBL5693005 0.67 CYP2A6 (0.37) CYP2A6ALDH1A1CYP1A2TSHRHPGD
SCHEMBL4304587 0.67 CYP1A2 (0.44) CYP2A6ALDH1A1CYP1A2TSHRHPGD
SCHEMBL19280 0.65
SCHEMBL4647758 0.64 CYP1A2 (0.59) CYP2A6ALDH1A1CYP1A2TSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0251049-B1 PHOTOPOLYMERISABLE REGISTRATION MATERIALS, PHOTORESIST LAYERS AND LITHOGRAPHIC PRINTING PLATES BASED ON THESE REGISTRATION MATERIALS BASF Aktiengesellschaft (DE) 1992-09-09 EP claimed
EP-0057474-B1 ACYLPHOSPHINE OXDE COMPOUNDS, THEIR PREPARATION AND USE BASF Aktiengesellschaft (DE) 1984-10-17 EP claimed
US-4298738-A PHOTOINITIATORS IN PHOTOPOLYMERIZABLE COATINGS AND IMKS BASF AKTIENGESELLSCHAFT (DE) 1981-11-03 US claimed
US-11681222-B2 Fluorine-containing polymer, purification method, and radiation-sensitive resin composition JSR CORPORATION (JP) 2023-06-20 US disclosed
US-20220137508-A9 FLUORINE-CONTAINING POLYMER, PURIFICATION METHOD, AND RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2022-05-05 US disclosed
US-20210278764-A1 FLUORINE-CONTAINING POLYMER, PURIFICATION METHOD, AND RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2021-09-09 US disclosed
US-11036133-B2 Fluorine-containing polymer, purification method, and radiation-sensitive resin composition JSR CORPORATION (JP) 2021-06-15 US disclosed
US-20200124961-A1 FLUORINE-CONTAINING POLYMER, PURIFICATION METHOD, AND RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2020-04-23 US disclosed
US-10620534-B2 Fluorine-containing polymer, purification method, and radiation-sensitive resin composition JSR CORPORATION (JP) 2020-04-14 US disclosed
US-20190278175-A9 FLUORINE-CONTAINING POLYMER, PURIFICATION METHOD, AND RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2019-09-12 US disclosed
US-20190025695-A1 FLUORINE-CONTAINING POLYMER, PURIFICATION METHOD, AND RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2019-01-24 US disclosed
EP-1225480-A2 Radiation-sensitive resin composition JSR Corporation (JP) 2002-07-24 EP disclosed
US-6399805-B2 SUCH AS LITHIUM 2,6-DIMETHYLBENZOYLPHENYLPHOSPHINE, USE AS PHOTOINITIATORS IN PHOTOCURABLE COMPOSITIONS SUCH AS FOR PHOTOGRAPHIC PRODUCTION OF RELIEF IMAGES CIBA SPECIALTY CHEMICALS CORPORATION 2002-06-04 US disclosed
US-20020026049-A1 Photoinitiators for acrylate coatings CIBA SPECIALTY CHEMICALS CORP. 2002-02-28 US disclosed
US-20010031898-A1 Organometallic monoacylarylphosphines CIBA SPECIALTY CHEMICALS CORP. 2001-10-18 US disclosed
EP-0446175-A2 Mixture of photoinitiators CIBA-GEIGY AG (CH) 1991-09-11 EP disclosed
US-4719297-A Acylphosphine compounds and their use as photoinitiators BASF AKTIENGESELLSCHAFT (DE) 1988-01-12 US disclosed
US-4710523-A DISCOLORATION, WEAR RESISTANT SURFACE COATING, FINISHES, AND PRINTING INK BASF AKTIENGESELLSCHAFT (DE) 1987-12-01 US disclosed
US-4522693-A Photopolymerizable composition with acylphosphine sulfide photoinitiator and method BASF AKTIENGESELLSCHAFT (DE) 1985-06-11 US disclosed
US-4298738-A PHOTOINITIATORS IN PHOTOPOLYMERIZABLE COATINGS AND IMKS BASF AKTIENGESELLSCHAFT (DE) 1981-11-03 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 (2 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-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 CYP2A6 1937/4885ALDH1A1 3984/4885CYP1A2 2020/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 CYP2A6 484/4885ALDH1A1 835/4885CYP1A2 328/4885

“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.