SCHEMBL9737264

SCHEMBL9737264

CCN(c1ccc2ccccc2c1)c1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
KDM4E B2RXH2 2/20 0.52
USP2 O75604 2/20 0.52
LMNA P02545 2/20 0.52
HPGD P15428 2/20 0.52
HIF1A Q16665 2/20 0.52
HSD17B10 Q99714 2/20 0.52
CA2 P00918 2/20 0.52
TSHR P16473 1/20 0.52
BLM P54132 1/20 0.52
SLC12A2 P55011 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
SLC6A4 P31645 1/20 0.48
AQP1 P29972 1/20 0.40
PTGS2 P35354 3/20 0.39
PTGES O14684 5/20 0.36
ALOX5 P09917 4/20 0.36
NSD2 O96028 1/20 0.36
ESR1 P03372 1/20 0.36
POLB P06746 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
SCHEMBL11795238 0.91 ALDH1A1 (0.57) ALDH1A1KDM4EUSP2LMNAHPGD
SCHEMBL9738547 0.85 CA2 (0.39) ALDH1A1KDM4EUSP2LMNAHPGD
SCHEMBL9738317 0.85 KDM4E (0.52) ALDH1A1KDM4EUSP2LMNAHPGD
SCHEMBL9737828 0.85 ALOX5 (0.40) ALDH1A1KDM4EUSP2LMNAHPGD
SCHEMBL574683 0.83 ALDH1A1 (0.60) ALDH1A1KDM4EUSP2LMNAHPGD
SCHEMBL2741876 0.82 ALDH1A1 (0.59) ALDH1A1KDM4EUSP2LMNAHPGD
SCHEMBL572711 0.79 LMNA (0.62) ALDH1A1KDM4EUSP2LMNAHPGD
SCHEMBL15677231 0.79 ALDH1A1 (0.56) ALDH1A1KDM4EUSP2LMNAHPGD
SCHEMBL2741882 0.79 ALDH1A1 (0.59) ALDH1A1KDM4EUSP2LMNAHPGD
SCHEMBL9736354 0.79 PTGES (0.36) ALDH1A1KDM4EUSP2LMNAHPGD

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
JP-2290843-A None JP disclosed
US-5145867-A NAPHTHYLALKYLAMINO-SUBSTITUTED SULFAMOYLBENZOIC ACID DERIVATIVES, AND THE USE THEREOF AS MEDICINES HOECHST AKTIENGESELLSCHAFT (DE) 1992-09-08 US disclosed
JP-H02290843-A NAPHTHYLALKYLAMINO-SUBSTITUTED SULFAMOYLBENZOIC ACID DERIVATIVE HOECHST AG 1990-11-30 JP disclosed