SCHEMBL8946359

SCHEMBL8946359

Cc1ncc(NC(=O)Nc2c(C(C)C)cccc2C(C)C)c(-c2ccccc2Cl)n1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 9/20 0.53
NTRK3 Q16288 3/20 0.48
LPAR1 Q92633 5/20 0.47
NTRK2 Q16620 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL8946668 0.89 LPAR1 (0.47) NTRK1LPAR1KMT2A
SCHEMBL8946569 0.87 LPAR1 (0.46) NTRK1LPAR1KMT2A
SCHEMBL8946618 0.86 L3MBTL1 (0.51) NTRK1NTRK3LPAR1NTRK2KMT2A
SCHEMBL8946592 0.85 LPAR1 (0.47) LPAR1
SCHEMBL8946926 0.85 NTRK1 (0.53) NTRK1NTRK3NTRK2KMT2A
SCHEMBL8946582 0.84 LPAR1 (0.50) NTRK1LPAR1KMT2A
SCHEMBL8946655 0.84 LPAR1 (0.46) NTRK1LPAR1KMT2A
SCHEMBL8946420 0.83 L3MBTL1 (0.47) NTRK1NTRK3LPAR1NTRK2
SCHEMBL8946575 0.83 MEN1 (0.43) LPAR1KMT2A
SCHEMBL8946495 0.82 MEN1 (0.42) LPAR1KMT2A

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