SCHEMBL9691604

SCHEMBL9691604

COc1csc(-c2scc(OC)c2C)c1C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.33
GRM5 P41594 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
KEAP1 Q14145 1/20 0.31
GAA P10253 3/20 0.31
MAPT P10636 3/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
PKM P14618 1/20 0.30
KMT2A Q03164 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL21737795 0.75
SCHEMBL31586137 0.75
SCHEMBL25953069 0.74 ACHE (0.39) ACHECA12CA1CA2CA4
SCHEMBL21721597 0.72 LMNA (0.31) HPGD
SCHEMBL21234920 0.69 CA1 (0.38) ACHECA12CA1CA2CA4
SCHEMBL13811735 0.67 TUBB4A (0.38) ACHECA12CA1CA2CA4
SCHEMBL9511479 0.67 ACHE (0.42) ACHECA12CA1CA2CA4
SCHEMBL9548099 0.66 CYP3A4 (0.46) KEAP1GAAMAPTALDH1A1HPGD
SCHEMBL7762228 0.65 ADRA1D (0.32) POLB
SCHEMBL4072257 0.65

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
US-5098529-A ELECTROCHEMICAL PROCESS FOR THE PRODUCTION OF ELECTRICALLY CONDUCTING POLY(ALKOXYTHIOPHENES) WITH CARBOXYLIC ACIDS ADDED HOECHST AKTIENGESELLSCHAFT (DE) 1992-03-24 US disclosed
EP-0416571-A2 Process for the electrochemical preparation, with the addition of carboxylic acids, of electroconductive poly (alkoxythiophenes) HOECHST AKTIENGESELLSCHAFT (DE) 1991-03-13 EP disclosed
EP-0416570-A2 Process for the electrochemical preparation, with the addition of Brönsted acids, of electroconductive poly(alkoxythiophenes) HOECHST AKTIENGESELLSCHAFT (DE) 1991-03-13 EP disclosed