SCHEMBL9853209

SCHEMBL9853209

C=Cc1sccc1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPT P10636 2/20 0.43
PTPN2 P17706 2/20 0.43
PTPN6 P29350 2/20 0.43
PTPRB P23467 1/20 0.43
POLB P06746 1/20 0.43
NR4A1 P22736 1/20 0.43
RECQL P46063 1/20 0.43
ESR2 Q92731 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 5/20 0.40
MAPK1 P28482 2/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 2/20 0.40
GLA P06280 2/20 0.40
GAA P10253 1/20 0.40
ALOX15 P16050 2/20 0.36
CYP1A2 P05177 1/20 0.36
CA12 O43570 2/20 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
SCHEMBL5549783 0.81 MEN1 (0.44) MEN1KMT2AMAPTPTPN2PTPN6
SCHEMBL9853151 0.79 HDAC1 (0.42) MEN1KMT2AMAPTPTPN2PTPN6
SCHEMBL28028973 0.77 CYP3A4 (0.42) KMT2APOLBALDH1A1MAPK1KDM4E
SCHEMBL27597007 0.73 PTPN1 (0.53) MEN1KMT2AMAPTPTPN2PTPN6
SCHEMBL4784842 0.71
SCHEMBL8292435 0.71 GAA (0.44) MEN1KMT2AMAPTPTPN2PTPN6
SCHEMBL3801503 0.71 KMT2A (0.40) MEN1KMT2AMAPTPTPN2PTPN6
SCHEMBL15276735 0.70 MEN1 (0.50) MEN1KMT2AMAPTPTPN2PTPN6
SCHEMBL5552846 0.69 ALDH1A1 (0.42) MEN1KMT2AMAPTPTPN2PTPN6
SCHEMBL8257074 0.69 MEN1 (0.38) MEN1KMT2AMAPTPTPN2PTPN6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0413293-A2 1-(Benzo[b]thienyl)-2-(thienyl) ethenes and related compounds, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-02-20 EP disclosed
US-4904674-A FREE OF AGGLOMERATION OF FIBRILLATION HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1990-02-27 US disclosed