SCHEMBL23966571

SCHEMBL23966571

CNC(=O)Cn1nc(Cc2nc3cc(OC(F)(F)F)c(Cl)cc3[nH]2)c2ccccc2c1=O

nearest known ligand 0.84

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 14/20 0.84
RAB9A P51151 1/20 0.44
TP53 P04637 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
AKR1B1 P15121 1/20 0.42

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
SCHEMBL23908925 0.92 S1PR2 (1.00) S1PR2
SCHEMBL23908926 0.91 S1PR2 (0.86) S1PR2TP53POLB
SCHEMBL23914706 0.89 S1PR2 (0.82) S1PR2TP53
SCHEMBL23966542 0.89 S1PR2 (0.82) S1PR2POLB
SCHEMBL23914728 0.88 S1PR2 (0.80) S1PR2TP53POLB
SCHEMBL23966875 0.87 S1PR2 (0.74) S1PR2TP53MAPT
SCHEMBL23908745 0.87 S1PR2 (0.73) S1PR2MAPT
SCHEMBL23908915 0.86 S1PR2 (0.72) S1PR2TP53POLBMAPTSMN1; SMN2
SCHEMBL23914855 0.85 S1PR2 (0.77) S1PR2TP53
SCHEMBL23908860 0.84 S1PR2 (0.81) S1PR2RAB9AMAPTSMN1; SMN2

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
EP-3649119-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GALAPAGOS NV (BE) 2021-11-03 EP disclosed