SCHEMBL10765657

SCHEMBL10765657

CCCCN(N)C(=O)c1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.53
HDAC3 O15379 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
GAA P10253 2/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 2/20 0.43
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43
S1PR1 P21453 1/20 0.43
NPC1 O15118 1/20 0.42
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NSD2 O96028 1/20 0.41

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
SCHEMBL27300572 0.85 HPGD (0.45) HDAC3HDAC1HDAC2GAAHPGD
SCHEMBL2777453 0.84 RAB9A (0.53) HTR7HPGDRAB9ANPC1NSD2
SCHEMBL4054017 0.83 HPGD (0.54) HDAC3HDAC1HDAC2GAAHPGD
SCHEMBL27930512 0.83 S1PR1 (0.48) S1PR1
SCHEMBL19997023 0.81 HTR7 (0.54) HTR7HDAC3HDAC1HDAC2GAA
SCHEMBL1130569 0.80 HSD17B3 (0.53) GAAHPGDEGFRTDP1
SCHEMBL10441296 0.79 HDAC3 (0.45) HDAC3HDAC1HDAC2GAAHPGD
SCHEMBL8390583 0.79 HSD17B3 (0.54) EGFR
SCHEMBL1545820 0.78 HPGD (0.49) HDAC3HDAC1HDAC2GAAHPGD
SCHEMBL4433083 0.77 CES2 (0.50) HDAC1GAAHPGDRAB9ANPC1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0228564-A2 Novel insecticidal diacylhydrazine compounds AMERICAN CYANAMID COMPANY (US) 1987-07-15 EP claimed