SCHEMBL1722959

SCHEMBL1722959

[CH2]c1cnc(-c2ccncc2)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 3/20 0.46
DBF4 Q9UBU7 3/20 0.46
KDM4E B2RXH2 7/20 0.44
ALDH1A1 P00352 4/20 0.44
HPGD P15428 4/20 0.44
HSD17B10 Q99714 2/20 0.44
MAPT P10636 3/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.41
ALOX15 P16050 1/20 0.41
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP19A1 P11511 3/20 0.39
PIK3CD O00329 1/20 0.39
PIK3CA P42336 1/20 0.39

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
SCHEMBL2096089 0.80 NPC1 (0.50) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL31657695 0.78 HSD17B1 (0.50) CDC7DBF4KDM4EALDH1A1HPGD
SCHEMBL2095935 0.77 SMN1; SMN2 (0.53) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL10959189 0.77 CDC7 (0.49) CDC7DBF4KDM4EALDH1A1HPGD
SCHEMBL2090443 0.77 PTPN11 (0.44) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL2684464 0.77 KDM4E (0.52) CDC7DBF4KDM4EALDH1A1HPGD
SCHEMBL1722963 0.77 CDC7 (0.53) CDC7DBF4KDM4EALDH1A1HPGD
SCHEMBL2498473 0.77 SNCA (0.53) CDC7DBF4KDM4EALDH1A1HPGD
SCHEMBL18641441 0.77 HSD17B1 (0.50) KDM4EALDH1A1MAPTLMNACYP2C9
SCHEMBL3057473 0.76 KIF11 (0.44) KDM4EALDH1A1MAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2344486-B1 ALKYLTHIAZOL CARBAMATE DERIVATIVES, PREPARATION THEREOF AND THEIR USE AS FAAH INHIBITORS SANOFI SA (FR) 2013-03-27 EP disclosed
EP-2344486-A2 ALKYLTHIAZOL CARBAMATE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2011-07-20 EP disclosed
WO-2010010288-A2 ALKYLTHIAZOL CARBAMATE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-01-28 WO disclosed