SCHEMBL8973612

SCHEMBL8973612

Cc1ccccc1Cc1nc(-c2ccccc2)[nH]c1C

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 1/20 0.46
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
NPY5R Q15761 1/20 0.43
HPGDS O60760 1/20 0.43
AR P10275 1/20 0.42
RPS6KA3 P51812 1/20 0.42
TNKS O95271 1/20 0.42
PARP1 P09874 1/20 0.42
TNKS2 Q9H2K2 1/20 0.42
CHEK2 O96017 1/20 0.42
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.41
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.39
P2RX7 Q99572 1/20 0.38
LTA4H P09960 1/20 0.38

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
SCHEMBL8972962 0.85 SMN1; SMN2 (0.45) PIN1DRD2DRD4DRD3NPY5R
SCHEMBL8764478 0.82 PIN1 (0.50) PIN1DRD2DRD4DRD3NPY5R
SCHEMBL28412520 0.78 PIN1 (0.53) PIN1DRD2DRD4DRD3NPY5R
SCHEMBL8973605 0.78 PIN1 (0.46) PIN1DRD2DRD4DRD3NPY5R
SCHEMBL8973218 0.77 KDM4E (0.46) PIN1DRD2DRD4DRD3NPY5R
SCHEMBL1099825 0.77 PIN1 (0.56) PIN1DRD2DRD4DRD3NPY5R
SCHEMBL1436137 0.77 PIN1 (0.51) PIN1DRD2DRD4DRD3NPY5R
SCHEMBL8973149 0.76 MAPK13 (0.47) PIN1DRD2DRD4DRD3NPY5R
SCHEMBL8973635 0.76 DRD2 (0.47) PIN1DRD2DRD4DRD3NPY5R
Hydrochloric Acid SCHEMBL1436115 0.76 PIN1 (0.50) PIN1DRD2DRD4DRD3NPY5R

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-5560785-A TREATING SURFACE WITH SOLUTION OF IMIDAZOLE COMPOUND, COPPER COMPOUND, ZINC COMPOUND, STABILIZERS SHIKOKU CHEMICALS CORPORATION (JP) 1996-10-01 US disclosed
US-5498301-A ON A PRINTED WIRING BOARD, HEAT RESISTANT, MOISTURE RESISTANT, A 2-ARYLIMIDAZOLE, CARBOXYLIC ACID, AMMONIA, WATER SHIKOKU CHEMICALS CORPORATION (JP) 1996-03-12 US disclosed
EP-0627499-A1 Agent for treating surfaces of copper and copper alloys SHIKOKU CHEMICALS CORPORATION (JP) 1994-12-07 EP disclosed