SCHEMBL8946445

SCHEMBL8946445

CCOC(=O)c1ccc(-c2ccccc2)nc1-c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 2/20 0.68
ALDH1A1 P00352 9/20 0.63
SMN1; SMN2 Q16637 6/20 0.63
MAPT P10636 3/20 0.63
LMNA P02545 3/20 0.63
MAPK1 P28482 2/20 0.63
ATM Q13315 1/20 0.63
KDM4E B2RXH2 7/20 0.55
TDP1 Q9NUW8 4/20 0.55
L3MBTL1 Q9Y468 4/20 0.55
ADORA3 P0DMS8 3/20 0.55
CCR6 P51684 1/20 0.53
TSHR P16473 1/20 0.53
HSD17B10 Q99714 2/20 0.52
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
HPGD P15428 4/20 0.52
HTT P42858 1/20 0.52
GPR55 Q9Y2T6 1/20 0.52
NPSR1 Q6W5P4 2/20 0.51

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
SCHEMBL28509330 0.92 MDM2 (0.60) MDM2ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL31091350 0.92 MDM2 (0.60) MDM2ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL4132138 0.92 MDM2 (0.60) MDM2ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL28516955 0.92 MDM2 (0.60) MDM2ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL4434197 0.87 MDM2 (0.67) MDM2ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL9183040 0.85 MDM2 (0.53) MDM2ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL9784691 0.85 KDM4E (0.55) MDM2ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL29232726 0.85 CCR6 (0.56) MDM2ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL5091732 0.84 ALDH1A1 (0.61) MDM2ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL4131672 0.84 KDM4E (0.54) MDM2ALDH1A1SMN1; SMN2MAPTLMNA

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