SCHEMBL13706015

SCHEMBL13706015

O=Cc1ccc(-c2c3ccccc3c(-c3ccc(C=O)s3)c3ccccc23)s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.52
KDM4E B2RXH2 3/20 0.49
MAPT P10636 3/20 0.49
HPGD P15428 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
CYP2A6 P11509 3/20 0.49
CYP2E1 P05181 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2B6 P20813 1/20 0.49
CYP2C19 P33261 1/20 0.49
APP P05067 1/20 0.47
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 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
SCHEMBL13897248 0.87 MAPT (0.47) DPP4KDM4EMAPTHPGDMEN1
SCHEMBL278904 0.79 DPP4 (0.65) DPP4KDM4EMAPTHPGDMEN1
SCHEMBL607254 0.77 DPP4 (0.69) DPP4KDM4EMAPTHPGDMEN1
SCHEMBL70783 0.77 APP (0.67) DPP4KDM4EMAPTHPGDMEN1
SCHEMBL12577701 0.76 DPP4 (0.49) DPP4KDM4EMAPTHPGDMEN1
SCHEMBL4218405 0.76 KDM4E (0.47) DPP4KDM4EMAPTHPGDMEN1
SCHEMBL7905308 0.73 APP (0.68) DPP4KDM4EMAPTHPGDMEN1
SCHEMBL10472980 0.73 APP (0.73) DPP4KDM4EMAPTHPGDMEN1
SCHEMBL5357392 0.72 IMPDH2 (0.49) DPP4KDM4EMAPTHPGDMEN1
SCHEMBL16140264 0.71 DPP4 (0.62) DPP4KDM4EMAPTHPGDMEN1

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
US-7589166-B2 Thiophene-containing compound and polymer thereof FUJI XEROX CO., LTD. (JP) 2009-09-15 US disclosed
US-7589166-B2 Thiophene-containing compound and polymer thereof FUJI XEROX CO., LTD. (JP) 2009-09-15 US disclosed