SCHEMBL2862979

SCHEMBL2862979

CC(C)(C)c1ccc(NC(=O)Oc2cnn(-c3ccccn3)c2C(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 7/20 0.44
SLC11A2 P49281 1/20 0.41
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
P2RY1 P47900 4/20 0.40
P2RY14 Q15391 1/20 0.39
UGCG Q16739 1/20 0.38

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
SCHEMBL2861607 0.89 TRPV1 (0.42) TRPV1SMN1; SMN2P2RY1P2RY14
SCHEMBL2854611 0.88 TRPV1 (0.41) TRPV1SLC11A2KDM4EGAASMN1; SMN2
SCHEMBL2856974 0.85 MAPT (0.39) TRPV1KDM4EGAASMN1; SMN2
SCHEMBL2854810 0.82 KMT2A (0.46) SLC11A2KDM4EGAAP2RY1
SCHEMBL2857895 0.82 GRM4 (0.48) SLC11A2KDM4ESMN1; SMN2
SCHEMBL2861567 0.81 MALT1 (0.41) SLC11A2KDM4ESMN1; SMN2
SCHEMBL2848538 0.80 MAPT (0.45) TRPV1SMN1; SMN2
SCHEMBL2857586 0.79 ATR (0.39) SLC11A2KDM4EGAASMN1; SMN2P2RY1
SCHEMBL2852605 0.79 HPGD (0.37) SLC11A2KDM4EGAASMN1; SMN2
SCHEMBL2858156 0.79 MAPT (0.41) TRPV1KDM4ESMN1; 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-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed