SCHEMBL7975142

SCHEMBL7975142

COC(=O)NC(=N)c1cc[c]c(F)c1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
S1PR3 Q99500 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PLAU P00749 1/20 0.31

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
SCHEMBL7989160 0.87 KDM4E (0.40) HPGDALDH1A1LMNAHSD17B10KDM4E
SCHEMBL7986786 0.86
SCHEMBL7992358 0.85 HPGD (0.44) HPGDALDH1A1LMNA
SCHEMBL7989503 0.83 CYP1A2 (0.40) HPGDALDH1A1LMNAS1PR3KDM4E
SCHEMBL7985688 0.83 RAB9A (0.46) HPGDALDH1A1LMNAKDM4E
SCHEMBL7988773 0.81 ALDH1A1 (0.38) HPGDALDH1A1LMNAALOX15HSD17B10
SCHEMBL7986407 0.78
SCHEMBL422919 0.78 CA1 (0.47) HPGDALDH1A1LMNAALOX15HSD17B10
SCHEMBL7985710 0.76
SCHEMBL6564601 0.76 ALDH1A1 (0.37) HPGDALDH1A1LMNAALOX15HSD17B10

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-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed