SCHEMBL27586151

SCHEMBL27586151

Cc1cc(-c2cccs2)c(C(=O)O)cc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
GPR35 Q9HC97 2/20 0.48
PTPN1 P18031 1/20 0.44
AR P10275 1/20 0.43
DHODH Q02127 1/20 0.41
BAZ2B Q9UIF8 1/20 0.41
BAZ2A Q9UIF9 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
RXFP1 Q9HBX9 2/20 0.41
PRNP P04156 1/20 0.41
PPARG P37231 1/20 0.41
NCOR2 Q9Y618 1/20 0.41
SRPK1 Q96SB4 1/20 0.40
RPS6KB2 Q9UBS0 1/20 0.40
FTO Q9C0B1 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL12279980 0.88 GPR35 (0.51) KDM4EGPR35PTPN1ARBAZ2B
SCHEMBL1823757 0.86 GPR35 (0.52) KDM4EGPR35PTPN1ARBAZ2B
Hydrochloric Acid SCHEMBL1825977 0.84 GPR35 (0.51) KDM4EGPR35PTPN1ARBAZ2B
SCHEMBL18952893 0.81 GPR35 (0.59) KDM4EGPR35PTPN1MEN1KMT2A
SCHEMBL2482769 0.79 SRPK1 (0.51) KDM4EGPR35PTPN1ARMEN1
SCHEMBL10338606 0.79 SRPK1 (0.51) KDM4EGPR35PTPN1ARMEN1
SCHEMBL25273104 0.78 ALDH1A1 (0.55) KDM4EKMT2APPARGLMNAALOX15
SCHEMBL1823348 0.78 ALDH1A1 (0.55) KDM4EKMT2APPARGLMNAALOX15
SCHEMBL10024278 0.77 KDM4E (0.54) KDM4EPTPN1DHODHFTO
SCHEMBL10024261 0.77 PTPN1 (0.55) KDM4EPTPN1DHODHFTO

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
CN-1529706-A Piperazine derivatives - 2004-09-15 CN claimed
CN-1780612-B Treatment of incontinence with 5HT2C agonists. PFIZER 2010-12-01 CN disclosed
CN-1780612-A Treatment of incontinence with 5HT2C agonists. PFIZER (US) 2006-05-31 CN disclosed