SCHEMBL11092969

SCHEMBL11092969

COCCOC1=C(c2ccc(Cl)cc2Cl)C(=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALPL P05186 1/20 0.39
▸ HTT P42858 1/20 0.37
▸ CYP3A4 P08684 1/20 0.36
▸ DPP4 P27487 1/20 0.36
▸ DPP8 Q6V1X1 1/20 0.36
▸ CRHR1 P34998 2/20 0.36
▸ S1PR4 O95977 1/20 0.36
▸ HTR2C P28335 2/20 0.36
▸ HTR2B P41595 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ SLC6A3 Q01959 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
SCHEMBL11096652 0.84 CYP11B2 (0.39) ALPLHTTCYP3A4DPP4DPP8
SCHEMBL11099881 0.73 KMT2A (0.40) ALPLMEN1KMT2AMAPTSLC6A3
SCHEMBL11093534 0.72 CYP11B2 (0.40) HTTMEN1KMT2AMAPT
SCHEMBL11126219 0.71 KMT2A (0.44) MEN1KMT2A
SCHEMBL11095288 0.71 MEN1 (0.46) HTTMEN1KMT2AMAPT
SCHEMBL10899959 0.71 KMT2A (0.41) MEN1KMT2AMAPT
SCHEMBL11094866 0.68 SMN1; SMN2 (0.41) DPP4MEN1KMT2AMAPT
SCHEMBL11092748 0.66 GAA (0.35) ALPLMEN1KMT2AMAPT
SCHEMBL11099876 0.65 SRD5A2 (0.42) ALPL
SCHEMBL4815741 0.64 MAOB (0.63) HTR2C

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
US-4436666-A HERBICIDES, MITICIDWS UNION CARBIDE CORPORATION (US) 1984-03-13 — — US disclosed
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