SCHEMBL7429418

SCHEMBL7429418

CCC(C)[C@H](NC(=O)N1CCCCCC1)C(=O)NCCCC(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.50
▸ FAAH O00519 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ ALOX12 P18054 1/20 0.50
▸ MTOR P42345 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ KMT2A Q03164 3/20 0.49
▸ CACNA1B Q00975 2/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ BLM P54132 1/20 0.49
▸ PMP22 Q01453 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ SCN5A Q14524 1/20 0.45
▸ SLC6A3 Q01959 4/20 0.43
▸ CACNA1F O60840 1/20 0.43
▸ ADORA3 P0DMS8 1/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ TACR2 P21452 1/20 0.43

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
SCHEMBL7391849 0.91 CACNA1B (0.52) MAPK1FAAHCYP3A4CYP2D6TSHR
SCHEMBL7389626 0.83 CACNA1B (0.67) MAPK1FAAHCYP3A4CYP2D6TSHR
SCHEMBL7656059 0.75 CACNA1B (0.60) MAPK1FAAHCYP3A4CYP2D6TSHR
SCHEMBL7385278 0.75 CACNA1B (0.55) MAPK1FAAHCYP3A4CYP2D6TSHR
SCHEMBL7385281 0.75 CACNA1B (0.55) MAPK1FAAHCYP3A4CYP2D6TSHR
SCHEMBL7429201 0.74 CACNA1B (0.66) MAPK1FAAHCYP3A4CYP2D6TSHR
SCHEMBL7392894 0.74 CACNA1B (0.54) MAPK1FAAHCYP3A4CYP2D6TSHR
SCHEMBL7394739 0.74 CACNA1B (0.61) MAPK1FAAHCYP3A4CYP2D6TSHR
SCHEMBL7394742 0.74 CACNA1B (0.61) MAPK1FAAHCYP3A4CYP2D6TSHR
SCHEMBL7382703 0.73 CACNA1B (0.58) MAPK1FAAHCYP3A4CYP2D6TSHR

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
WO-1999055688-A1 SUBSTITUTED DIARYLALKYL AMIDES AS CALCIUM CHANNEL ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1999-11-04 — — WO claimed
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