SCHEMBL5801725

SCHEMBL5801725

COc1ccc(O)cc1Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.56
ELANE P08246 4/20 0.53
CTSG P08311 1/20 0.53
BCL2 P10415 1/20 0.48
BCL2L1 Q07817 1/20 0.48
F2 P00734 1/20 0.46
TTR P02766 1/20 0.46
CYP19A1 P11511 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
SCHEMBL29098359 0.86 ALOX5 (0.61) ALOX5ELANECTSGBCL2BCL2L1
SCHEMBL343656 0.86 ALOX5 (0.59) ALOX5ELANEBCL2BCL2L1F2
SCHEMBL31555136 0.85 ABCB1 (0.58)
SCHEMBL7283988 0.85 CALM1 (0.50) CYP19A1
SCHEMBL2090122 0.82 CA2 (0.57)
SCHEMBL29066049 0.81 TUBB4A (0.59)
SCHEMBL30297719 0.81 ALOX5 (0.54) ALOX5ELANECTSGBCL2BCL2L1
SCHEMBL4512063 0.81 ALOX5 (0.50) ALOX5ELANECTSGF2
SCHEMBL3958050 0.81 GPR55 (0.50)
SCHEMBL11288852 0.81 LTA4H (0.58)

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105073744-A Novel heterocyclic compounds as bromodomain inhibitors RVX THERAPEUTICS INC 2015-11-18 CN claimed
WO-2006077483-A2 METHOD FOR THE PRODUCTION OF ALKOXY-SUBSTITUTED PHENOLS MERISOL RSA (PTY) LTD (ZA) 2006-07-27 WO claimed
CN-105073744-B Novel heterocyclic compounds as bromine structural domain inhibitor ZENITH EPIGENETICS CORP. (CA) 2019-11-08 CN disclosed
CN-105073744-A Novel heterocyclic compounds as bromodomain inhibitors RVX THERAPEUTICS INC 2015-11-18 CN disclosed
WO-2006077483-A3 METHOD FOR THE PRODUCTION OF ALKOXY-SUBSTITUTED PHENOLS MERISOL RSA PTY LTD (ZA) 2006-10-05 WO disclosed
WO-2006077483-A2 METHOD FOR THE PRODUCTION OF ALKOXY-SUBSTITUTED PHENOLS MERISOL RSA (PTY) LTD (ZA) 2006-07-27 WO disclosed
WO-2006077483-A2 METHOD FOR THE PRODUCTION OF ALKOXY-SUBSTITUTED PHENOLS MERISOL RSA (PTY) LTD (ZA) 2006-07-27 WO disclosed