SCHEMBL17310439

SCHEMBL17310439

CCCCc1ccc(NC(=O)N2CCC(F)(c3ncccc3C)CC2)cc1.Cc1cccnc1C1(F)CCN(C(=O)Nc2ccc(-c3ccccc3)cc2)CC1.Cc1cccnc1C1(F)CCN(C(=O)Nc2ccc(Cc3ccccc3)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 5/20 0.47
▸ NPY5R Q15761 1/20 0.46
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ FAAH O00519 2/20 0.41
▸ NAMPT P43490 1/20 0.41
▸ PDGFRB P09619 1/20 0.40
▸ CNR2 P34972 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
SCHEMBL2723775 0.91 TRPV1 (0.55) TRPV1NPY5RMEN1KMT2AKDM4E
SCHEMBL2724809 0.91 TRPV1 (0.55) TRPV1
SCHEMBL2726587 0.90 TRPV1 (0.56) TRPV1KDM4EMAPTFAAHPDGFRB
SCHEMBL31679062 0.90 TRPV1 (0.56) TRPV1KDM4EMAPTFAAHPDGFRB
SCHEMBL17310441 0.89 TRPV1 (0.40) TRPV1NPY5RMEN1KMT2AKDM4E
SCHEMBL2725244 0.87 TRPV1 (0.59) TRPV1NPY5RKDM4EMAPT
SCHEMBL31679069 0.87 TRPV1 (0.59) TRPV1NPY5RKDM4EMAPT
SCHEMBL2724882 0.82 TRPV1 (0.58) TRPV1KMT2AMAPTFAAH
SCHEMBL31679064 0.82 TRPV1 (0.58) TRPV1KMT2AMAPTFAAH
SCHEMBL19946397 0.80 TRPV1 (0.56) TRPV1KMT2AKDM4EMAPTFAAH

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-20150352105-A1 METHODS AND COMPOSITIONS FOR PREVENTION AND TREATMENT OF CARDIAC HYPERTROPHY NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2015-12-10 — — US disclosed
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