SCHEMBL6559253

SCHEMBL6559253

CC1(C)CC(N)c2cc(C(=O)O)ccc2O1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
KDM1A O60341 2/20 0.40
RARB P10826 7/20 0.39
RARG P13631 7/20 0.39
RARA P10276 6/20 0.39
AKR1B1 P15121 1/20 0.37
CYP26A1 O43174 1/20 0.36
CYP26B1 Q9NR63 1/20 0.36
RXRB P28702 2/20 0.35
MAPT P10636 1/20 0.35
RXRG P48443 1/20 0.35
ALOX5 P09917 1/20 0.35

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
SCHEMBL6561155 0.85 RAB9A (0.43) MEN1KMT2AALDH1A1RARBRARG
SCHEMBL3456479 0.84 MEN1 (0.51) RXRAMEN1KMT2ATDP1ALDH1A1
SCHEMBL7479500 0.77 HTR2C (0.42) MEN1KMT2ATDP1AKR1B1
SCHEMBL6560005 0.77 KCNE1 (0.43) RXRAMEN1KMT2ATDP1ALDH1A1
SCHEMBL6024993 0.76 CNR1 (0.48) KDM1AMAPT
SCHEMBL3322619 0.76 TRPV1 (0.41) KDM1AAKR1B1
SCHEMBL6024969 0.76 BACE1 (0.37) ALDH1A1KDM1AAKR1B1
SCHEMBL6025054 0.76 BACE1 (0.37) ALDH1A1KDM1AAKR1B1
SCHEMBL6024931 0.76 TRPV1 (0.41) KDM1AAKR1B1
SCHEMBL3409160 0.76 CNR1 (0.48) KDM1AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807629-B1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them AVENTIS PHARMA GMBH (DE) 2004-03-03 EP disclosed
US-6191164-B1 POTASSIUM CHANNEL MODULATORS; ANTIULCER AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
EP-0807629-A1 Sulfonamido substituted chromane derivatives, method for their preparation, their use as medicaments or diagnostic agents aswell as medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-19 EP disclosed