SCHEMBL9738547

SCHEMBL9738547

CCN(c1ccc2ccccc2c1)c1cc(C(=O)O)cc(S(N)(=O)=O)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
USP2 O75604 2/20 0.39
LMNA P02545 2/20 0.39
HPGD P15428 2/20 0.39
HIF1A Q16665 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TSHR P16473 1/20 0.39
BLM P54132 1/20 0.39
SLC12A2 P55011 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KMT2A Q03164 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PTGES O14684 2/20 0.39
ALOX5 P09917 2/20 0.39
NSD2 O96028 1/20 0.38
ESR1 P03372 1/20 0.38
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38

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
SCHEMBL9737828 0.88 ALOX5 (0.40) CA2ALDH1A1KDM4EUSP2LMNA
SCHEMBL9737264 0.85 ALDH1A1 (0.52) CA2ALDH1A1KDM4EUSP2LMNA
SCHEMBL9737103 0.83 CA2 (0.39) CA2ALDH1A1KDM4EUSP2LMNA
SCHEMBL9736354 0.82 PTGES (0.36) CA2ALDH1A1KDM4EUSP2LMNA
SCHEMBL574542 0.76 KMT2A (0.46) CA2ALDH1A1KDM4EUSP2LMNA
SCHEMBL11787224 0.75 NSD2 (0.44) CA2ALDH1A1KDM4EUSP2LMNA
SCHEMBL11795238 0.75 ALDH1A1 (0.57) CA2ALDH1A1KDM4EUSP2LMNA
SCHEMBL11784469 0.73 NSD2 (0.42) CA2ALDH1A1KDM4EUSP2LMNA
SCHEMBL9736980 0.72 CA2 (0.37) CA2ALDH1A1KDM4EUSP2LMNA
SCHEMBL574056 0.71 PKM (0.45) CA2ALDH1A1LMNAKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5145867-A NAPHTHYLALKYLAMINO-SUBSTITUTED SULFAMOYLBENZOIC ACID DERIVATIVES, AND THE USE THEREOF AS MEDICINES HOECHST AKTIENGESELLSCHAFT (DE) 1992-09-08 US disclosed