SCHEMBL15534267

SCHEMBL15534267

Oc1ccc(-c2cc(Nc3cccc(C(F)(F)F)n3)ncn2)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 5/20 0.56
▸ TP53 P04637 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ ABL1 P00519 10/20 0.46
▸ BCR P11274 10/20 0.46
▸ SYK P43405 1/20 0.46
▸ TAS2R14 Q9NYV8 1/20 0.41
▸ FAAH O00519 1/20 0.41
▸ JAK2 O60674 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
SCHEMBL15533815 0.90 TRPV1 (0.48) TRPV1TP53MAPTABL1BCR
SCHEMBL15534101 0.89 TRPV1 (0.47) TRPV1TP53MAPTABL1BCR
SCHEMBL15534259 0.89 TRPV1 (0.57) TRPV1ABL1BCRFAAH
SCHEMBL15533871 0.88 TP53 (0.51) TRPV1TP53MAPTABL1BCR
Bromide SCHEMBL15534396 0.88 TRPV1 (0.47) TRPV1TP53MAPTABL1BCR
Hydrochloric Acid SCHEMBL15533549 0.88 TRPV1 (0.47) TRPV1TP53MAPTABL1BCR
SCHEMBL15534464 0.88 ABL1 (0.46) TRPV1TP53MAPTABL1BCR
SCHEMBL15534449 0.85 TRPV1 (0.47) TRPV1TP53MAPTABL1BCR
SCHEMBL15533746 0.84 SYK (0.48) TRPV1MAPTABL1BCRSYK
SCHEMBL15533972 0.84 ABL1 (0.53) TP53MAPTABL1BCRSYK

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-2013175415-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF Piramal Enterprises Limited (IN) 2013-11-28 — — WO claimed
WO-2013175415-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF Piramal Enterprises Limited (IN) 2013-11-28 — — WO disclosed
Send feedback