SCHEMBL11842810

SCHEMBL11842810

COC(=O)N1CCC(Nc2ccc(Cl)cc2N)C(C)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.42
▸ ABL1 P00519 1/20 0.39
▸ USP30 Q70CQ3 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ DRD4 P21917 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ KCNH2 Q12809 1/20 0.37
▸ HTR4 Q13639 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ OPRK1 P41145 1/20 0.37
▸ MDM2 Q00987 2/20 0.37
▸ PDE4B Q07343 3/20 0.36
▸ NOS1 P29475 1/20 0.36
▸ NOS2 P35228 1/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ PDE4C Q08493 1/20 0.36

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
SCHEMBL27349799 0.91 USP30 (0.48) MAPTUSP30MEN1KMT2AALDH1A1
SCHEMBL11836392 0.83 PKM (0.45) MAPTMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL25388905 0.81 MAPT (0.47) MAPTUSP30MEN1KMT2AALDH1A1
SCHEMBL31288366 0.81 MAPT (0.47) MAPTUSP30MEN1KMT2AALDH1A1
SCHEMBL31282954 0.81 MAPT (0.47) MAPTUSP30MEN1KMT2AALDH1A1
SCHEMBL31282832 0.81 MAPT (0.47) MAPTUSP30MEN1KMT2AALDH1A1
SCHEMBL31282640 0.81 MAPT (0.47) MAPTUSP30MEN1KMT2AALDH1A1
SCHEMBL25388421 0.80 MAPT (0.50) MAPTMEN1KMT2ADRD2DRD4
SCHEMBL25389728 0.80 MAPT (0.50) MAPTMEN1KMT2ADRD2DRD4
SCHEMBL25389700 0.80 MAPT (0.50) MAPTMEN1KMT2ADRD2DRD4

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-3989707-A NEUROLEPTIC AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1976-11-02 — — US disclosed
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