SCHEMBL435618

SCHEMBL435618

Clc1ccc([C]2CCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
CYP2A6 P11509 1/20 0.44
PTGS2 P35354 2/20 0.44
PTGS1 P23219 1/20 0.44
CYP1A2 P05177 1/20 0.43
SLC6A3 Q01959 2/20 0.40
SIGMAR1 Q99720 1/20 0.40
HTR2C P28335 1/20 0.39
AHR P35869 1/20 0.39
AKR1C3 P42330 1/20 0.38
AKR1C1 Q04828 1/20 0.38
RAB9A P51151 3/20 0.37
HTT P42858 2/20 0.37
NPC1 O15118 2/20 0.37
AR P10275 1/20 0.37
HPGD P15428 1/20 0.37
BRD4 O60885 1/20 0.37
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL218474 0.94 LMNA (0.44) LMNACYP2A6PTGS2PTGS1CYP1A2
SCHEMBL434059 0.92 HTT (0.44) LMNACYP2A6PTGS2PTGS1CYP1A2
SCHEMBL8125538 0.92 HTT (0.44) LMNACYP2A6PTGS2PTGS1CYP1A2
SCHEMBL315185 0.88 LMNA (0.50) LMNACYP2A6PTGS2PTGS1CYP1A2
SCHEMBL6077152 0.74 PDE7A (0.37) LMNACYP2A6PTGS2PTGS1CYP1A2
SCHEMBL6075715 0.74 NPC1 (0.39) LMNACYP2A6PTGS2CYP1A2SLC6A3
SCHEMBL6503383 0.74 MAOA (0.43) LMNACYP1A2SIGMAR1RAB9A
SCHEMBL14332467 0.72 ALDH1A1 (0.53) LMNARAB9AHTTNPC1HPGD
SCHEMBL15562085 0.72 TSHR (0.44) PTGS2PTGS1SLC6A3TSHRSMN1; SMN2
SCHEMBL353494 0.72 MAPK14 (0.50) PTGS2PTGS1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105980387-B Serine/threonine kinase inhibitor 阵列生物制药公司 2019-04-19 CN claimed
EP-3363788-A1 CANNABINOID RECEPTOR MODULATORS Arena Pharmaceuticals, Inc. (US) 2018-08-22 EP claimed
EP-3089980-B1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2018-01-31 EP claimed
US-9670208-B2 Serine/threonine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2017-06-06 US claimed
EP-3089980-A1 SERINE/THREONINE KINASE INHIBITORS Array Biopharma, Inc. (US) 2016-11-09 EP claimed
US-20160304519-A1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2016-10-20 US claimed
CN-105980387-A Serine/threonine kinase inhibitors 阵列生物制药公司 2016-09-28 CN claimed
WO-2015103137-A1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2015-07-09 WO claimed
CN-102083797-B Tetrahydroisoquinolines, pharmaceutical compositions containing them and their use in therapy ABBOTT GMBH & CO KG 2014-06-04 CN claimed
US-20130165412-A1 CANNABINOID RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2013-06-27 US claimed
CN-101468956-A Schiff base compound and synthesizing method thereof BYD CO LTD (CN) 2009-07-01 CN claimed
US-20080045503-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 AMGEN INC. 2008-02-21 US claimed
US-7253196-B2 Inhibitors of 11-β-hydroxy steroid dehydrogenase type 1 AMGEN, INC. (US) 2007-08-07 US claimed
CN-1964956-A Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 AMGEN (US) 2007-05-16 CN claimed
EP-1753736-A2 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 Amgen Inc. (US) 2007-02-21 EP claimed
US-20060142357-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 AMGEN INC. 2006-06-29 US claimed
WO-2005116002-A2 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 AMGEN INC. (US) 2005-12-08 WO claimed
US-20050239853-A1 New compounds BIOVITRUM AB (SE) 2005-10-27 US claimed
WO-2005075471-A2 THIAZOL-COMPOUNDS AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS BIOVITRUM AB (SE) 2005-08-18 WO claimed
WO-2002036540-A2 PROCESS FOR PREPARATION OF β-PHENETHYLAMINE DERIVATIVE TORRENT PHARMACEUTICALS LTD (IN) 2002-05-10 WO claimed

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-20080045503-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD3B1, HSD17B1 LMNA 1410/4885CYP2A6 170/4885PTGS2 2093/4885
US-20050239853-A1 New compounds HSD11B1, CYP11B1, HSD3B1 LMNA 1964/4885CYP2A6 108/4885PTGS2 807/4885
US-20160304519-A1 SERINE/THREONINE KINASE INHIBITORS TTBK1, MAP3K1, TNNI3K LMNA 1573/4885CYP2A6 4669/4885PTGS2 2310/4885
US-20060142357-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD3B1, HSD17B1 LMNA 1410/4885CYP2A6 170/4885PTGS2 2093/4885
US-20130165412-A1 CANNABINOID RECEPTOR MODULATORS CNR1, CNR2, TRPV1 LMNA 1260/4885CYP2A6 2057/4885PTGS2 977/4885

“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.