SCHEMBL2368935

SCHEMBL2368935

CCc1ncc2c(-c3ccccc3)csc2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TSHR P16473 1/20 0.43
LMNA P02545 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
DAPK3 O43293 1/20 0.40
PRKD3 O94806 1/20 0.40
MAP4K4 O95819 1/20 0.40
ABL1 P00519 1/20 0.40
NTRK1 P04629 1/20 0.40
LCK P06239 1/20 0.40
CSF1R P07333 1/20 0.40
RET P07949 1/20 0.40
MET P08581 1/20 0.40
PDGFRB P09619 1/20 0.40
FGFR1 P11362 1/20 0.40
PDGFRA P16234 1/20 0.40
PRKACA P17612 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
SCHEMBL6358684 0.84 LMNA (0.40) ALDH1A1ALOX15MAPK1HSD17B10TSHR
SCHEMBL30341175 0.80 ALDH1A1 (0.46) ALDH1A1TSHRLMNASMN1; SMN2DAPK3
SCHEMBL30341183 0.78 NPC1 (0.47) ALDH1A1MAPK1LMNASMN1; SMN2DAPK3
SCHEMBL2368300 0.76 ESR1 (0.47) ALDH1A1MAPK1HSD17B10TSHRLMNA
SCHEMBL14965210 0.76 ADORA1 (0.50) ALDH1A1LMNASMN1; SMN2DAPK3PRKD3
SCHEMBL6356763 0.76 SQOR (0.37) ALDH1A1ALOX15MAPK1HSD17B10TSHR
SCHEMBL2369195 0.76 DAPK3 (0.40) ALDH1A1ALOX15MAPK1HSD17B10TSHR
SCHEMBL2368984 0.76 FGFR1 (0.41) ALDH1A1MAPK1HSD17B10TSHRLMNA
SCHEMBL2368787 0.75 CYP1A2 (0.42) ALDH1A1MAPK1HSD17B10TSHRDAPK3
SCHEMBL6359795 0.74 ALDH1A1 (0.42) ALDH1A1ALOX15MAPK1HSD17B10TSHR

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
US-8022076-B2 Thieno[2,3-d]pyrimidine derivatives as potassium channel modulators; antiarrhythmia agents XENTION LIMITED (GB) 2011-09-20 US disclosed