SCHEMBL19454530

SCHEMBL19454530

CNc1cnc(N(C)C(C)=O)nc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.37
KDM4E B2RXH2 5/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
RAB9A P51151 2/20 0.34
MAPT P10636 2/20 0.33
TSHR P16473 1/20 0.33
CYP1A2 P05177 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
HPGD P15428 1/20 0.33
SYK P43405 1/20 0.32
NPC1 O15118 1/20 0.32
TSPO P30536 1/20 0.31
CXCR1 P25024 1/20 0.31
CXCR2 P25025 1/20 0.31
HCAR3 P49019 1/20 0.31

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
SCHEMBL13002821 0.80 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2RAB9AMAPTLMNA
SCHEMBL19454935 0.78 ALDH1A1 (0.41) ALDH1A1KDM4EALOX15HSD17B10HDAC6
SCHEMBL568378 0.76 ALDH1A1 (0.39) ALDH1A1KDM4EALOX15HSD17B10HDAC1
SCHEMBL30299648 0.74 ALDH1A1 (0.45) ALDH1A1KDM4EALOX15HSD17B10SMN1; SMN2
SCHEMBL3121440 0.73 KDM4E (0.46) ALDH1A1KDM4EALOX15HSD17B10SMN1; SMN2
SCHEMBL568288 0.72 KDM4E (0.36) ALDH1A1KDM4EALOX15HSD17B10SMN1; SMN2
SCHEMBL13002831 0.68 ALDH1A1 (0.61) ALDH1A1KDM4EALOX15HSD17B10SMN1; SMN2
SCHEMBL13002824 0.68 L3MBTL1 (0.41) ALDH1A1KDM4EHSD17B10SMN1; SMN2MAPT
SCHEMBL3772652 0.67 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2RAB9AMAPTLMNA
SCHEMBL13752168 0.67 POLB (0.43) ALDH1A1KDM4EHSD17B10SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017175068-A1 THIAZOLOPYRIDINE DERIVATIVES AS GPR119 AGONISTS MANKIND PHARMA LTD. (IN) 2017-10-12 WO disclosed