SCHEMBL8946460

SCHEMBL8946460

CC(C)c1cccc(C(C)C)c1NC(=O)Nc1cnc(-c2ccccc2)nc1-c1ccccc1C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 13/20 0.43
LPAR1 Q92633 1/20 0.43
P2RY1 P47900 1/20 0.41
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE4B Q07343 1/20 0.40
NTRK3 Q16288 1/20 0.39

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
SCHEMBL8946473 0.87 NTRK1 (0.45) NTRK1LPAR1LMNAKMT2ANTRK3
SCHEMBL8946455 0.87 NTRK1 (0.56) NTRK1LPAR1LMNAKMT2ANTRK3
SCHEMBL8946507 0.86 NTRK1 (0.44) NTRK1KMT2A
SCHEMBL8946564 0.86 NTRK1 (0.48) NTRK1LPAR1LMNAKMT2ANTRK3
SCHEMBL8946618 0.85 L3MBTL1 (0.51) NTRK1LPAR1LMNAKMT2ANTRK3
SCHEMBL8946752 0.83 LPAR1 (0.59) NTRK1LPAR1LMNAKMT2APDE4B
SCHEMBL8946757 0.83 NTRK1 (0.48) NTRK1LPAR1LMNAKMT2ANTRK3
SCHEMBL8946725 0.81 NTRK1 (0.50) NTRK1LPAR1P2RY1LMNAKMT2A
SCHEMBL8946762 0.81 NTRK1 (0.45) NTRK1LPAR1LMNAKMT2ANTRK3
SCHEMBL8946571 0.80 LPAR1 (0.50) NTRK1LPAR1LMNAKMT2ANTRK3

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
US-5500424-A ENZYME INHIBITORS NIHON NOHYAKU CO., LTD. (JP) 1996-03-19 US disclosed
EP-0638557-A1 N-phenylpyri(mi)dine-N'-phenyl-urea derivatives, their preparation and their use as ACAT inhibitors NIHON NOHYAKU CO., LTD. (JP) 1995-02-15 EP disclosed