SCHEMBL8946589

SCHEMBL8946589

Cc1cccc(C(C)(C)C)c1NC(=O)Nc1cnc(-c2ccccc2)nc1-c1ccccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
NTRK1 P04629 5/20 0.44
PYGL P06737 9/20 0.42
NTRK3 Q16288 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL8946617 0.91 L3MBTL1 (0.53) L3MBTL1NTRK1PYGLNTRK3
SCHEMBL8946420 0.86 L3MBTL1 (0.47) L3MBTL1NTRK1PYGLNTRK3
SCHEMBL8946504 0.85 L3MBTL1 (0.47) L3MBTL1NTRK1PYGLNTRK3
SCHEMBL8946728 0.84 L3MBTL1 (0.51) L3MBTL1NTRK1PYGLNTRK3MEN1
SCHEMBL8946618 0.82 L3MBTL1 (0.51) L3MBTL1NTRK1NTRK3KMT2A
SCHEMBL8946576 0.82 L3MBTL1 (0.51) L3MBTL1NTRK1NTRK3KMT2A
SCHEMBL8946920 0.81 L3MBTL1 (0.50) L3MBTL1NTRK1MEN1KMT2A
SCHEMBL8946307 0.81 L3MBTL1 (0.50) L3MBTL1NTRK1PYGLNTRK3MEN1
SCHEMBL8946547 0.81 L3MBTL1 (0.49) L3MBTL1NTRK1MEN1KMT2A
SCHEMBL8946654 0.80 L3MBTL1 (0.55) L3MBTL1NTRK1MEN1KMT2A

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