SCHEMBL8534684

SCHEMBL8534684

Cc1cc2c(cc1C)C(=O)C(CC(=O)O)CC2

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.50
ITGB3 P05106 13/20 0.47
ITGA2B P08514 13/20 0.47
PPARD Q03181 3/20 0.46
CYP26A1 O43174 2/20 0.43
CYP24A1 Q07973 1/20 0.41
FFAR1 O14842 1/20 0.40
PPARA Q07869 1/20 0.40

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
SCHEMBL8536553 0.82 DGAT1 (0.57) DGAT1ITGB3ITGA2BPPARDCYP26A1
SCHEMBL8531874 0.82 DGAT1 (0.36) DGAT1ITGB3ITGA2BCYP26A1CYP24A1
SCHEMBL12978373 0.82 DGAT1 (0.50) DGAT1ITGB3ITGA2BCYP26A1FFAR1
SCHEMBL8534988 0.81 CYP11B1 (0.41) DGAT1CYP26A1
SCHEMBL4622497 0.78 CYP26A1 (0.70) DGAT1ITGB3ITGA2BCYP26A1CYP24A1
SCHEMBL9638064 0.78 CYP19A1 (0.64) DGAT1ITGB3ITGA2BCYP26A1CYP24A1
SCHEMBL11723357 0.77 THRA (0.52)
SCHEMBL10341531 0.77 CYP26A1 (0.59) DGAT1ITGB3ITGA2BCYP26A1
SCHEMBL29405721 0.77 CYP19A1 (0.49) DGAT1ITGB3ITGA2BCYP26A1FFAR1
SCHEMBL18321998 0.77 CYP19A1 (0.49) DGAT1ITGB3ITGA2BCYP26A1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10120632-A None JP disclosed
US-5847159-A 1- ω-(3,4-dihydro-2-naphthalenyl)alkyl!-cyclic amine derivatives, process for preparing the same, and pharmaceutical composition containing the same DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-12-08 US disclosed
JP-H10120632-A N-CYCLOALKYL-(OMEGA-(3,4-DIHYDRO-2NAPHTHALENYL) ALKYL)AMINE DERIVATIVE AND MEDICINE CONTAINING THE SAME DAINIPPON PHARMACEUT CO LTD 1998-05-12 JP disclosed
EP-0825180-A1 1-OMEGA-(3,4-DIHYDRO-2-NAPHTHALENYL)ALKYL] CYCLIC AMINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-02-25 EP disclosed