SCHEMBL7899205

SCHEMBL7899205

CCOc1cccc2oc(C(N)=S)cc(=O)c12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.54
GPR35 Q9HC97 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
LMNA P02545 2/20 0.53
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
HIF1A Q16665 1/20 0.51
MAPT P10636 3/20 0.49
KDM4E B2RXH2 3/20 0.49
PABPC1 P11940 1/20 0.49
ABCG2 Q9UNQ0 8/20 0.47
CYP2A6 P11509 1/20 0.46
ABCB1 P08183 2/20 0.44
BCHE P06276 1/20 0.44
ACHE P22303 1/20 0.44
GRK6 P43250 1/20 0.43
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
RECQL P46063 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL7896333 0.88 GPR35 (0.50) HPGDGPR35TDP1LMNAMEN1
SCHEMBL7897916 0.87 GPR35 (0.49) HPGDGPR35TDP1LMNAMEN1
SCHEMBL15832516 0.85 GPR35 (0.72) HPGDGPR35TDP1LMNAMEN1
SCHEMBL7896281 0.85 ALDH1A1 (0.57) HPGDGPR35TDP1LMNAMEN1
SCHEMBL15832512 0.83 GPR35 (0.55) HPGDGPR35TDP1LMNAMEN1
SCHEMBL6949194 0.81 HPGD (0.51) HPGDGPR35TDP1LMNAMEN1
SCHEMBL26645927 0.75 NMT2 (0.54) GPR35TDP1LMNAMEN1KMT2A
SCHEMBL6957654 0.75 POLH (0.55) HPGDMEN1KMT2AMAPTKDM4E
SCHEMBL12325504 0.75 HPGD (0.56) HPGDGPR35TDP1LMNAMEN1
SCHEMBL9847114 0.75 GPR35 (0.69) HPGDGPR35TDP1LMNAMEN1

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