SCHEMBL899322

SCHEMBL899322

CCOC(=O)Oc1ccc(N=c2sc(-c3cccnc3F)cn2Cc2ccccc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 6/20 0.35
OPRK1 P41145 3/20 0.35
OPRM1 P35372 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
F2RL3 Q96RI0 1/20 0.34
LMNA P02545 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GNRHR P30968 2/20 0.33
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
MAPK1 P28482 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL903008 0.89 F2RL3 (0.44) MEN1KMT2AF2RL3LMNAALDH1A1
SCHEMBL899483 0.85 PTGS2 (0.36) LMNAALDH1A1MAPTKDM4ENPC1
SCHEMBL898805 0.83 GRM5 (0.34) ALDH1A1MAPTNPSR1MAPK1KDM4E
SCHEMBL898806 0.83 GRM5 (0.34) ALDH1A1MAPTNPSR1MAPK1KDM4E
SCHEMBL899218 0.70 PDE4D (0.38) ALDH1A1MAPTNPSR1MAPK1CRHBP
SCHEMBL899220 0.70 PDE4D (0.38) ALDH1A1MAPTNPSR1MAPK1CRHBP
SCHEMBL2570512 0.68 OPRD1 (0.54) OPRD1OPRK1OPRM1LMNAALDH1A1
SCHEMBL899307 0.65 MAPT (0.46) LMNAALDH1A1MAPTNPSR1MAPK1
SCHEMBL899306 0.65 MAPT (0.46) LMNAALDH1A1MAPTNPSR1MAPK1
SCHEMBL898781 0.65 ROCK2 (0.41) LMNANPSR1MAPK1NPC1RAB9A

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
WO-2012040754-A2 NOVEL THIAZOLAMINE DERIVATES AS DIFFERENTIATION ACCELERATORS TECHNISCHE UNIVERSITÄT WIEN (AT) 2012-04-05 WO claimed
WO-2012040754-A2 NOVEL THIAZOLAMINE DERIVATES AS DIFFERENTIATION ACCELERATORS TECHNISCHE UNIVERSITÄT WIEN (AT) 2012-04-05 WO disclosed