SCHEMBL29328630

SCHEMBL29328630

CCC(N)(Cl)C(=O)OC1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.43
NAAA Q02083 2/20 0.41
CYP19A1 P11511 2/20 0.39
HTT P42858 1/20 0.36
CYP2C19 P33261 1/20 0.34
CHRM2 P08172 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
HRH1 P35367 2/20 0.33
KCNH2 Q12809 2/20 0.33
MLNR O43193 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
OPRM1 P35372 1/20 0.33
DRD3 P35462 1/20 0.33
OPRK1 P41145 1/20 0.33
HTR2B P41595 1/20 0.33
SLC6A3 Q01959 1/20 0.33
CACNA1C Q13936 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL29327761 0.98 EPHX1 (0.46) EPHX1NAAACYP19A1HTTCYP2C19
SCHEMBL29328733 0.82 EPHX1 (0.40) EPHX1NAAACYP19A1HTTCYP2C19
SCHEMBL12877198 0.81 EPHX1 (0.50) EPHX1NAAACYP19A1HTTCYP2C19
SCHEMBL7899893 0.80 EPHX1 (0.44) EPHX1NAAACYP19A1HTTCYP2C19
Hydrochloric Acid SCHEMBL1200168 0.80 EPHX1 (0.49) EPHX1NAAACYP19A1HTTCYP2C19
SCHEMBL132134 0.76 EPHX1 (0.47) EPHX1NAAACYP19A1HTTCYP2C19
SCHEMBL29327785 0.75 CYP19A1 (0.42) EPHX1NAAACYP19A1HTTCYP2C19
SCHEMBL3345151 0.75 CYP19A1 (0.47) EPHX1NAAACYP19A1HTTCYP2C19
SCHEMBL26357258 0.75 CYP19A1 (0.47) EPHX1NAAACYP19A1HTTCYP2C19
SCHEMBL985072 0.74 CYP19A1 (0.42) EPHX1NAAACYP19A1HTTCYP2C19

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
WO-2024150676-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION 富士フイルム株式会社 2024-07-18 WO disclosed