SCHEMBL802264

SCHEMBL802264

CC(C)C1CCOc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAP3K14 Q99558 2/20 0.42
ITGB2 P05107 1/20 0.41
ICAM1 P05362 1/20 0.41
ITGAL P20701 1/20 0.41
SSTR4 P31391 1/20 0.39
LMNA P02545 2/20 0.38
CRHBP P24387 2/20 0.38
CRHR2 Q13324 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HTT P42858 1/20 0.38
KCNH2 Q12809 2/20 0.36
HTR2A P28223 1/20 0.35
USP1 O94782 2/20 0.34
XIAP P98170 1/20 0.34
ABCB1 P08183 1/20 0.33

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
SCHEMBL12609018 1.00 MAP3K14 (0.42) MAP3K14ITGB2ICAM1ITGALSSTR4
SCHEMBL12609033 1.00 MAP3K14 (0.42) MAP3K14ITGB2ICAM1ITGALSSTR4
SCHEMBL14313741 0.89 ITGB2 (0.39) MAP3K14ITGB2ICAM1ITGALSSTR4
SCHEMBL17084099 0.89 ITGB2 (0.39) MAP3K14ITGB2ICAM1ITGALSSTR4
SCHEMBL29332749 0.86 MAP3K14 (0.40) MAP3K14ITGB2ICAM1ITGALSSTR4
SCHEMBL21423461 0.86 ITGB2 (0.39) MAP3K14ITGB2ICAM1ITGALSSTR4
SCHEMBL28297416 0.81 ITGB2 (0.41) MAP3K14ITGB2ICAM1ITGALSSTR4
SCHEMBL13139753 0.81 LTB4R (0.40) LMNASMN1; SMN2
SCHEMBL13059129 0.81 LTB4R (0.40) LMNASMN1; SMN2
SCHEMBL20077675 0.81 LTB4R (0.40) LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239792-A1 MODULATORS OF BCL-2 OR BCL-2/BCL-XL AND USES THEREOF ASIA VISION LIMITED (CN) 2024-07-18 US disclosed
WO-2023129564-A9 DEGRADERS OF GRK2 AND USES THEREOF CYGNAL THERAPEUTICS, INC. (US) 2024-02-08 WO disclosed
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use PLIANT THERAPEUTICS, INC. (US) 2024-01-02 US disclosed
US-11827617-B2 Piperidinyl nociceptin receptor compounds ASTRAEA THERAPEUTICS, LLC (US) 2023-11-28 US disclosed
US-20230373950-A1 IKAROS ZINC FINGER FAMILY DEGRADERS AND USES THEREOF GILEAD SCIENCES, INC. 2023-11-23 US disclosed
US-20230373950-A1 IKAROS ZINC FINGER FAMILY DEGRADERS AND USES THEREOF GILEAD SCIENCES, INC. 2023-11-23 US disclosed
US-20230355622-A1 METHODS OF CHEMOVACCINATION AGAINST PLASMODIUM INFECTIONS MERCK SHARP & DOHME LLC (US) 2023-11-09 US disclosed
US-20230355622-A1 METHODS OF CHEMOVACCINATION AGAINST PLASMODIUM INFECTIONS MERCK SHARP & DOHME LLC (US) 2023-11-09 US disclosed
US-20230353959-A1 PI3K-ALPHA INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2023-11-02 US disclosed
US-20230353959-A1 PI3K-ALPHA INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2023-11-02 US disclosed
US-20080249301-A1 Regioselective Process for Preparing Benzimidazole Thiophenes SMITHKLINE BEECHAM CORPORATION 2008-10-09 US disclosed
US-20080249301-A1 Regioselective Process for Preparing Benzimidazole Thiophenes SMITHKLINE BEECHAM CORPORATION 2008-10-09 US disclosed
US-20080214580-A1 6-SUBSTITUTED 2-(BENZIMIDAZOLYL)PURINE AND PURINONE DERIVATIVES FOR IMMUNOSUPPRESSION PHARMACOPEIA, INC. (US) 2008-09-04 US disclosed
US-20080085898-A1 8-SUBSTITUTED 2-(BENZIMIDAZOLYL)PURINE DERIVATIVES FOR IMMUNOSUPPRESSION PHARMACOPEIA, INC. (US) 2008-04-10 US disclosed
US-20080051404-A1 Heteroaryl compounds useful as inhibitors of E1 activating enzymes MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-02-28 US disclosed
US-20070191293-A1 Inhibitors of E1 activating enzymes MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-08-16 US disclosed
US-20070066666-A1 Thiazole compounds SMITHKLINE BEECHAM CORPORATION 2007-03-22 US disclosed
US-20070060576-A1 Process for preparing benzimidazole thiophenes SMITHKLINE BEECHAM CORPORATION 2007-03-15 US disclosed
US-20070060576-A1 Process for preparing benzimidazole thiophenes SMITHKLINE BEECHAM CORPORATION 2007-03-15 US disclosed
US-20070003680-A1 Bis-aromatic amides and their uses as sweet flavor modifiers, tastants, and taste enhancers SENOMYX, INC. 2007-01-04 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 (12 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-11827617-B2 Piperidinyl nociceptin receptor compounds OPRL1, OPRK1, OPRM1 MAP3K14 1645/4885ITGB2 2040/4885ICAM1 1035/4885
US-20080085898-A1 8-SUBSTITUTED 2-(BENZIMIDAZOLYL)PURINE DERIVATIVES FOR IMMUNOSUPPRESSION TPMT, KIT, ADORA2A MAP3K14 3159/4885ITGB2 3104/4885ICAM1 974/4885
US-20240239792-A1 MODULATORS OF BCL-2 OR BCL-2/BCL-XL AND USES THEREOF BCL2, BCL2L2, BCL2L1 MAP3K14 2860/4885ITGB2 2633/4885ICAM1 3516/4885
US-20230373950-A1 IKAROS ZINC FINGER FAMILY DEGRADERS AND USES THEREOF IKZF2, IKZF1, IKZF3 MAP3K14 2392/4885ITGB2 4446/4885ICAM1 2775/4885
US-20080051404-A1 Heteroaryl compounds useful as inhibitors of E1 activating enzymes RCE1, ECE1, UBE2E1 MAP3K14 1310/4885ITGB2 4243/4885ICAM1 2759/4885
US-20070060576-A1 Process for preparing benzimidazole thiophenes CYP3A4, TPMT, TYMP MAP3K14 2086/4885ITGB2 3714/4885ICAM1 4728/4885
US-20070066666-A1 Thiazole compounds CYP3A5, CYP2C19, CYP3A7 MAP3K14 3717/4885ITGB2 2167/4885ICAM1 4528/4885
US-20080214580-A1 6-SUBSTITUTED 2-(BENZIMIDAZOLYL)PURINE AND PURINONE DERIVATIVES FOR IMMUNOSUPPRESSION P2RY6, P2RY1, P2RX6 MAP3K14 2505/4885ITGB2 3654/4885ICAM1 1484/4885
US-20230355622-A1 METHODS OF CHEMOVACCINATION AGAINST PLASMODIUM INFECTIONS CTSL, PRCP, CPB1 MAP3K14 2093/4885ITGB2 1989/4885ICAM1 1983/4885
US-11858931-B2 Amino acid compounds with unbranched linkers and methods of use ITGA2B, ITGB6, ITGB1 MAP3K14 2814/4885ITGB2 9/4885ICAM1 119/4885
US-20080249301-A1 Regioselective Process for Preparing Benzimidazole Thiophenes CYP3A4, CYP2C19, CYP2B6 MAP3K14 1473/4885ITGB2 3217/4885ICAM1 4802/4885
US-20070191293-A1 Inhibitors of E1 activating enzymes ECE1, RNASE1, RCE1 MAP3K14 1108/4885ITGB2 4222/4885ICAM1 2019/4885

“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.