SCHEMBL7899233

SCHEMBL7899233

NC(=S)c1ccc(CCCCc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.53
MAOA P21397 1/20 0.52
HDAC1 Q13547 1/20 0.51
HTR2A P28223 1/20 0.50
HTR3A P46098 1/20 0.50
HDAC8 Q9BY41 1/20 0.49
IGF1R P08069 1/20 0.48
ALOX15 P16050 1/20 0.48
DPP4 P27487 1/20 0.46
LMNA P02545 1/20 0.46
NOS1 P29475 1/20 0.46
MAPT P10636 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
PLA2G10 O15496 1/20 0.46
PLA2G2A P14555 1/20 0.46

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
SCHEMBL7889275 0.98 HDAC1 (0.54) MAOBSMN1; SMN2MAOAHDAC1HTR2A
SCHEMBL7897928 0.98 HDAC1 (0.54) MAOBSMN1; SMN2MAOAHDAC1HTR2A
SCHEMBL7900704 0.92 SMN1; SMN2 (0.57) MAOBSMN1; SMN2MAOAHDAC1HTR2A
SCHEMBL7896985 0.85 PLA2G4B (0.58)
SCHEMBL7896350 0.84 PLA2G4B (0.60) MAOAHTR2A
SCHEMBL7897896 0.84 PLA2G4B (0.60) MAOAHTR2A
SCHEMBL7897904 0.83 PLA2G10 (0.64) SMN1; SMN2LMNAMAPTPLA2G10PLA2G2A
SCHEMBL7900761 0.83 IGF1R (0.49) MAOBMAOAHTR3AIGF1RALOX15
SCHEMBL28017864 0.83 FFAR1 (0.56) LMNA
SCHEMBL15679902 0.82 SMN1; SMN2 (0.62) SMN1; SMN2HTR2ALMNA

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