SCHEMBL7889287

SCHEMBL7889287

NC(=S)c1ccccc1CCCCCCCCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BID P55957 1/20 0.46
BCL2L1 Q07817 1/20 0.46
MCL1 Q07820 1/20 0.46
BAK1 Q16611 1/20 0.46
MAOA P21397 1/20 0.46
MAPT P10636 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
KMT2A Q03164 1/20 0.44
HTR3A P46098 1/20 0.44
MAOB P27338 2/20 0.44
SIGMAR1 Q99720 3/20 0.43
NAAA Q02083 3/20 0.41
LMNA P02545 1/20 0.41
NOS1 P29475 1/20 0.41
MIF P14174 1/20 0.41

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
SCHEMBL7900766 1.00 BID (0.46) BIDBCL2L1MCL1BAK1MAOA
SCHEMBL7896948 0.98 MAOA (0.47) BIDBCL2L1MCL1BAK1MAOA
SCHEMBL7900744 0.87 KMT2A (0.55) MAOAMAPTKMT2AMAOBLMNA
SCHEMBL7899209 0.83 LIPG (0.54) BIDBCL2L1MCL1BAK1MAPT
SCHEMBL7889302 0.83 LIPG (0.54) BIDBCL2L1MCL1BAK1MAPT
Iodide SCHEMBL8515618 0.81 LIPG (0.53) BIDBCL2L1MCL1BAK1MAPT
SCHEMBL29410986 0.81 BID (0.51) BIDBCL2L1MCL1BAK1MAOA
SCHEMBL2081561 0.81 LIPG (0.51) BIDBCL2L1MCL1BAK1MAPT
SCHEMBL4768903 0.79 LIPG (0.44) MAPTKMT2ALMNA
SCHEMBL7897721 0.78 TSHR (0.49) BCL2L1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6277998-B1 REACTING 2-CYANO-4-OXO-4H-BENZOPYRAN COMPOUND WITH HYDROGEN SULFIDE AND THEN REACTING PROUDCT WITH ALKYL HALIDE; REACTING THE PRODUCT WITH HYDRAZINE OR ITS SALT AND THEN WITH NITROUS ACID COMPOUND TO OBTAIN TETRAZOLE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-08-21 US disclosed
US-6191289-B1 REACTING A 4-OXO-4H-BENZOPYRAN GROUP SUBSTITUTED WITH AMIDE OR A PHENYL GROUP IN ITS 2 POSITION IS REACTED WITH ANHYDROUS HYDRAZINE OR SALT IN PRESENCE OF CATALYST FOLLOWED BY REACTING WITH NITROUS ACID OR SALT TO FORM TETRAZOLE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-02-20 US disclosed
US-5874593-A SULFUR CONTAINING AMIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-23 US disclosed
EP-0711762-A1 PROCESS FOR PRODUCING TETRAZOLE COMPOUND AND INTERMEDIATE THEREFOR SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-05-15 EP disclosed