SCHEMBL9474398

SCHEMBL9474398

CCCCCCCCCCC1CCC[CH]CCC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.56
SIGMAR1 Q99720 3/20 0.42
EPHX1 P07099 1/20 0.41
ALDH1A1 P00352 1/20 0.39
LSS P48449 2/20 0.38
HTT P42858 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TP53 P04637 1/20 0.36
PKM P14618 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
NAAA Q02083 1/20 0.34

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
SCHEMBL455412 0.96 CYP1A2 (0.52) CYP1A2SIGMAR1EPHX1ALDH1A1LSS
SCHEMBL3031906 0.94 CYP1A2 (0.54) CYP1A2SIGMAR1EPHX1ALDH1A1LSS
SCHEMBL3027364 0.90 CYP1A2 (0.55) CYP1A2SIGMAR1EPHX1ALDH1A1LSS
SCHEMBL9980491 0.88 CYP1A2 (0.47) CYP1A2SIGMAR1EPHX1ALDH1A1LSS
SCHEMBL11860033 0.88 CYP1A2 (0.47) CYP1A2SIGMAR1EPHX1ALDH1A1LSS
SCHEMBL9979063 0.88 CYP1A2 (0.47) CYP1A2SIGMAR1EPHX1ALDH1A1LSS
SCHEMBL21409484 0.88 CYP1A2 (0.57) CYP1A2SIGMAR1EPHX1LSSHTT
SCHEMBL9979053 0.88 CYP1A2 (0.47) CYP1A2SIGMAR1EPHX1ALDH1A1LSS
SCHEMBL9979342 0.88 CYP1A2 (0.47) CYP1A2SIGMAR1EPHX1ALDH1A1LSS
SCHEMBL144946 0.88 CYP1A2 (0.61) CYP1A2SIGMAR1HTTMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5264448-A Thioamides, oxazole ring, insecticides, miticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-11-23 US disclosed
US-5206259-A Insecticides, acaricides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-04-27 US disclosed
EP-0394043-A1 An amide compound and its production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-10-24 EP disclosed