SCHEMBL10972012

SCHEMBL10972012

Cc1ccc(C(=O)CCCCl)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.50
POLB P06746 3/20 0.48
CASP3 P42574 2/20 0.48
SENP8 Q96LD8 2/20 0.48
SENP7 Q9BQF6 2/20 0.48
SENP6 Q9GZR1 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 1/20 0.48
GSK3B P49841 3/20 0.44
KMT2A Q03164 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
RAB9A P51151 6/20 0.42
NPC1 O15118 5/20 0.42
MEN1 O00255 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
HTR1A P08908 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL5866598 0.89 DAO (0.53) DAOPOLBCASP3SENP8SENP7
SCHEMBL22721115 0.89 DAO (0.57) DAOPOLBCASP3SENP8SENP7
SCHEMBL15979700 0.85 DAO (0.61) DAOPOLBCASP3SENP8SENP7
SCHEMBL280123 0.82 DAO (0.55) DAOPOLBCASP3SENP8SENP7
SCHEMBL9378748 0.82 DAO (0.50) DAOPOLBCASP3SENP8SENP7
SCHEMBL3926030 0.81 GSK3B (0.66) DAOPOLBCASP3SENP8SENP7
SCHEMBL11196961 0.80 GSK3B (0.67) DAOPOLBCASP3SENP8SENP7
SCHEMBL24721882 0.79 DAO (0.55) DAOPOLBCASP3SENP8SENP7
SCHEMBL15979701 0.79 ALDH1A1 (0.68) DAOPOLBCASP3SENP8SENP7
SCHEMBL6609187 0.79 GSK3B (0.68) DAOPOLBALDH1A1HPGDGSK3B

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-0035228-B1 TETRAZOLE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, AND ANTI-ULCER COMPOSITION CONTAINING THE SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1985-01-02 EP disclosed
US-4372953-A Tetrazole derivatives, and anti-ulcer composition containing the same OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1983-02-08 US disclosed