SCHEMBL3052997

SCHEMBL3052997

Cc1cc(OCc2ccccc2)c2cc(C(=O)O)[nH]c2c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 3/20 0.70
SRD5A1 P18405 1/20 0.58
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
CYP1A2 P05177 2/20 0.53
HPGD P15428 2/20 0.53
HSD17B10 Q99714 2/20 0.53
CYP2C9 P11712 1/20 0.53
IDO1 P14902 1/20 0.51
TDO2 P48775 1/20 0.51
RHEB Q15382 1/20 0.48
DHODH Q02127 3/20 0.47
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
CTSV O60911 1/20 0.44
CTSL P07711 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43

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
SCHEMBL30954323 1.00 SRD5A2 (0.70) SRD5A2SRD5A1KDM4EALDH1A1CYP1A2
SCHEMBL11449788 0.90 SRD5A2 (0.57) SRD5A2SRD5A1KDM4EALDH1A1CYP1A2
SCHEMBL30024037 0.88 SRD5A2 (0.55) SRD5A2SRD5A1KDM4EALDH1A1HPGD
SCHEMBL3043331 0.88 SRD5A2 (0.55) SRD5A2SRD5A1KDM4EALDH1A1HPGD
SCHEMBL11450466 0.88 SRD5A2 (0.55) SRD5A2SRD5A1KDM4EALDH1A1CYP1A2
SCHEMBL30169467 0.86 SRD5A2 (0.72) SRD5A2SRD5A1KDM4EALDH1A1CYP1A2
SCHEMBL7168231 0.86 SRD5A2 (0.72) SRD5A2SRD5A1KDM4EALDH1A1CYP1A2
SCHEMBL7197823 0.85 SRD5A2 (0.67) SRD5A2SRD5A1KDM4EALDH1A1CYP1A2
SCHEMBL27189570 0.85 SRD5A2 (0.70) SRD5A2SRD5A1KDM4EALDH1A1CYP1A2
SCHEMBL28917206 0.84 SRD5A2 (0.66) SRD5A2SRD5A1KDM4EALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250059217-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF PREPARATION THEREOF BRIGHT MINDS BIOSCIENCES INC. (CA) 2025-02-20 US disclosed
CN-117897376-A Heterocyclic compounds and process for preparing same 光明智慧生物科学公司 2024-04-16 CN disclosed
EP-4347561-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF PREPARATION THEREOF Bright Minds Biosciences Inc. (CA) 2024-04-10 EP disclosed
WO-2022246554-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF PREPARATION THEREOF BRIGHT MINDS BIOSCIENCES INC. (CA) 2022-12-01 WO disclosed
US-7820630-B2 Substituted indole-O-glucosides JANSSEN PHARMACEUTICA NV (BE) 2010-10-26 US disclosed
US-20100009900-A1 SUBSTITUTED INDOLE-O-GLUCOSIDES BEAVERS MARY PAT 2010-01-14 US disclosed
US-20090105164-A1 SUBSTITUTED INDOLE-O-GLUCOSIDES BEAVERS MARY PAT 2009-04-23 US disclosed
US-7511022-B2 Substituted indole-O-glucosides JANSSEN PHARMACEUTICA N.V. (BE) 2009-03-31 US disclosed
US-20060293251-A1 Substituted indazole-O-glucosides JANSSEN PHARMACEUTICA, N.V. (BE) 2006-12-28 US disclosed
US-7129220-B2 Substituted indole-O-glucosides JANSSEN PHARMACEUTICA N.V (BE) 2006-10-31 US disclosed
US-20050037981-A1 Substituted indole-O-glucosides JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-17 US disclosed
US-4229464-A Aminopropanol substituted indole compounds and compositions for the treatment of cardiac and circulatory diseases BOEHRINGER MANNHEIM GMBH (DE) 1980-10-21 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 (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-20100009900-A1 SUBSTITUTED INDOLE-O-GLUCOSIDES GPR119, PYGL, IAPP SRD5A2 142/4885SRD5A1 158/4885KDM4E 2284/4885
US-20090105164-A1 SUBSTITUTED INDOLE-O-GLUCOSIDES GPR119, PYGL, IAPP SRD5A2 142/4885SRD5A1 158/4885KDM4E 2284/4885
US-20250059217-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF PREPARATION THEREOF OPRL1, OPRK1, CNR2 SRD5A2 1850/4885SRD5A1 1756/4885KDM4E 3590/4885
US-20050037981-A1 Substituted indole-O-glucosides GPR119, PYGL, IAPP SRD5A2 142/4885SRD5A1 158/4885KDM4E 2284/4885
US-20060293251-A1 Substituted indazole-O-glucosides GPR119, PYGL, GYS2 SRD5A2 142/4885SRD5A1 138/4885KDM4E 2847/4885

“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.