SCHEMBL9348192

SCHEMBL9348192

CC(C(=O)O)C1CCc2ccccc2C1=O

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
CYP19A1 P11511 3/20 0.49
SIGMAR1 Q99720 4/20 0.46
DRD2 P14416 2/20 0.46
HTR2A P28223 2/20 0.46
HTR2C P28335 2/20 0.46
HTR2B P41595 2/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ACHE P22303 3/20 0.42
HTR1A P08908 2/20 0.42
AKR1B1 P15121 1/20 0.41

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
SCHEMBL10388746 0.83 KDM4E (0.57) KDM4ECYP19A1SIGMAR1DRD2HTR2A
SCHEMBL10346131 0.82 KDM4E (0.55) KDM4ECYP19A1SIGMAR1DRD2HTR2A
SCHEMBL9345561 0.81 KDM4E (0.49) KDM4ECYP19A1SIGMAR1DRD2HTR2A
SCHEMBL11733442 0.80 PPARG (0.45) SIGMAR1ALDH1A1TSHR
SCHEMBL2139852 0.78 KDM4E (0.49) KDM4ECYP19A1SIGMAR1DRD2HTR2A
SCHEMBL15294423 0.77 KDM4E (0.64) KDM4ECYP19A1SIGMAR1DRD2HTR2A
SCHEMBL10389080 0.75 KDM4E (0.48) KDM4ECYP19A1SIGMAR1HTR2CNPC1
SCHEMBL10450126 0.74 KDM4E (0.45) KDM4ECYP19A1SIGMAR1DRD2HTR2A
SCHEMBL10448555 0.74 KDM4E (0.45) KDM4ECYP19A1SIGMAR1DRD2HTR2A
SCHEMBL9280515 0.73 KDM4E (0.49) KDM4ECYP19A1SIGMAR1DRD2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5288752-A Brain disorders SUNTORY LIMITED (JP) 1994-02-22 US disclosed
EP-0322248-B1 COMPOUNDS EFFECTIVE AGAINST CEREBRAL INSUFFICIENCY SUNTORY LIMITED (JP) 1993-08-04 EP disclosed
US-5179092-A Cognition activators SUNTORY LIMITED (JP) 1993-01-12 US disclosed
EP-0181145-B1 HETEROCYCLIC COMPOUNDS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1990-01-31 EP disclosed
EP-0322248-A2 Compounds effective against cerebral insufficiency SUNTORY LIMITED (JP) 1989-06-28 EP disclosed
US-4755511-A Tricyclic pyridazinone compounds SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1988-07-05 US disclosed
EP-0181145-A2 Heterocyclic compounds SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1986-05-14 EP disclosed