SCHEMBL28965124

SCHEMBL28965124

Clc1nc(CNC2CCCCC2)cs1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44
DRD3 P35462 1/20 0.44
ACHE P22303 2/20 0.43
GLA P06280 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
POLB P06746 1/20 0.42
HRH3 Q9Y5N1 1/20 0.41
USP2 O75604 1/20 0.41
PABPC1 P11940 1/20 0.40
CXCR4 P61073 1/20 0.39
OPRL1 P41146 1/20 0.38
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
HDAC1 Q13547 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL28958743 0.81 PDE10A (0.45) DRD2DRD4DRD3HTTHRH3
SCHEMBL8808928 0.80 GFER (0.56) DRD2DRD4DRD3ACHEHTT
SCHEMBL28958765 0.77 CYP2D6 (0.41) DRD2DRD4DRD3ACHEHTT
SCHEMBL15104529 0.77 DRD2 (0.43) DRD2DRD4DRD3ACHEGLA
SCHEMBL28958741 0.73 DRD2 (0.52) DRD2DRD4DRD3HTTHRH3
SCHEMBL31238944 0.70 CXCR4 (0.69) ACHEGLAHTTNPSR1POLB
SCHEMBL28958746 0.70 HRH3 (0.43) ACHEGLAHTTNPSR1POLB
SCHEMBL15104610 0.70 DRD2 (0.40) DRD2DRD4DRD3ACHEOPRL1
SCHEMBL15219310 0.69 PABPC1 (0.45) HTTPOLBHRH3USP2PABPC1
SCHEMBL29986167 0.68 LMNA (0.42) ACHEHTTHRH3USP2PABPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113264901-B Amino phenol oxygroup zinc complex containing 2-substituted thiazole-4-group and preparation method and application thereof 华东理工大学 2023-02-28 CN disclosed
CN-113264901-A Amino phenol oxygroup zinc complex containing 2-substituted thiazole-4-group and preparation method and application thereof 华东理工大学 2021-08-17 CN disclosed