SCHEMBL6910872

SCHEMBL6910872

CCc1ccc2ccccc2c1Cl

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 3/20 0.54
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
NCEH1 Q6PIU2 1/20 0.44
ATM Q13315 1/20 0.44
PAX8 Q06710 1/20 0.43
CYP1A2 P05177 1/20 0.41
HPRT1 P00492 1/20 0.41
CTRC Q99895 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL6683454 0.84 CYP2A6 (0.50) CYP2A6LMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL8895165 0.83 CYP2A6 (0.54) CYP2A6LMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL6683052 0.81 CYP2A6 (0.47) CYP2A6LMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL4453260 0.81 CYP2A6 (0.56) CYP2A6LMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL12013593 0.81 CYP2A6 (0.56) CYP2A6LMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL3169931 0.80 CYP2A6 (0.46) CYP2A6LMNASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL4697244 0.79 CYP2A6 (0.54) CYP2A6LMNASMN1; SMN2ALDH1A1TSHR
SCHEMBL6404480 0.79 CYP2A6 (0.54) CYP2A6ALDH1A1TSHRHSD17B10TDP1
SCHEMBL8578429 0.79 CYP2A6 (0.54) CYP2A6ALDH1A1TSHRHSD17B10TDP1
SCHEMBL1556062 0.79 NCEH1 (0.45) CYP2A6ALDH1A1TSHRHSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3527600-B1 ISOCYANATE COMPOSITION AND PRODUCTION METHOD FOR ISOCYANATE POLYMER ASAHI CHEMICAL IND (JP) 2025-07-09 EP disclosed
EP-3018118-B1 BASE GENERATOR, BASE-REACTIVE COMPOSITION CONTAINING SAID BASE GENERATOR, AND BASE GENERATION METHOD FUJIFILM WAKO PURE CHEMICAL CORP (JP) 2023-07-05 EP disclosed
US-20230114799-A1 ISOCYANATE COMPOSITION AND METHOD FOR PRODUCING ISOCYANATE POLYMER ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-04-13 US disclosed
US-11548975-B2 Isocyanate composition and method for producing isocyanate polymer ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-01-10 US disclosed
EP-3536683-B1 POLYISOCYANATE COMPOSITION AND ISOCYANATE POLYMER COMPOSITION ASAHI CHEMICAL IND (JP) 2021-11-24 EP disclosed
CN-107963982-B Polyisocyanate composition and isocyanate polymer composition 旭化成株式会社 2021-11-12 CN disclosed
EP-3016931-B1 A NOVEL PROCESS FOR THE PREPARATION OF TETRALIN AND NAPHTHALENE DERIVATIVES PHARMATHEN SA (GR) 2021-02-24 EP disclosed
EP-3372579-B1 POLYISOCYANATE COMPOSITION AND ISOCYANATE POLYMER COMPOSITION ASAHI CHEMICAL IND (JP) 2020-10-28 EP disclosed
EP-2915803-B1 POLYISOCYANATE COMPOSITION AND ISOCYANATE POLYMER COMPOSITION ASAHI CHEMICAL IND (JP) 2020-07-22 EP disclosed
US-10428014-B2 Base generator, base-reactive composition containing said base generator, and base generation method FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-01 US disclosed
WO-2009062285-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-05-22 WO disclosed
WO-2009062289-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-05-22 WO disclosed
WO-2009062308-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-05-22 WO disclosed
EP-0950052-B1 METHOD FOR PREPARING A TETRAHYDROPYRIDIN DERIVATIVE SANOFI SYNTHELABO (FR) 2004-09-08 EP disclosed
US-6118006-A REACTING 4-(3-TRIFLUOROMETHYLPHENYL)-1,2,3,6-TETRAHYDROPYRIDINE WITH2-(2-BROMOETHYL)NAPHTHALENE SANOFI-SYNTHELABO (FR) 2000-09-12 US disclosed
EP-0950052-A1 METHOD FOR PREPARING A TETRAHYDROPYRIDIN DERIVATIVE SANOFI-SYNTHELABO (FR) 1999-10-20 EP disclosed
WO-1998028273-A1 METHOD FOR PREPARING A TETRAHYDROPYRIDIN DERIVATIVE SANOFI (FR) 1998-07-02 WO disclosed
EP-0081384-B1 PROCESS FOR THE PREPARATION OF AROMATIC OR HETEROAROMATIC CARBOXYLATED COMPOUNDS Montedison S.p.A. (IT) 1986-04-02 EP disclosed
EP-0081384-A1 Process for the preparation of aromatic or heteroaromatic carboxylated compounds Montedison S.p.A. (IT) 1983-06-15 EP disclosed
US-RE30279-E FROM ALKYL OR ARYL HALIDE WITH HALO-SUBSTITUTED TRIVALENT PHOSPHORUS COMPOUNDS AND PHOSPHORUS PENTASULFIDE OR -OXIDE STAUFFER CHEMICAL COMPANY (US) 1980-05-20 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 (3 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-11548975-B2 Isocyanate composition and method for producing isocyanate polymer IDH3A, IDH2, IDH3B CYP2A6 681/4885LMNA 2021/4885SMN1; SMN2 3482/4885
US-10428014-B2 Base generator, base-reactive composition containing said base generator, and base generation method HPRT1, GNG2, BLM CYP2A6 1606/4885LMNA 3866/4885SMN1; SMN2 4004/4885
US-20230114799-A1 ISOCYANATE COMPOSITION AND METHOD FOR PRODUCING ISOCYANATE POLYMER IDH3A, IDH2, IDH3B CYP2A6 669/4885LMNA 1933/4885SMN1; SMN2 3286/4885

“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.