SCHEMBL8675765

SCHEMBL8675765

CC1(C)CCC(C)(C)c2cc(OCc3ccc(CC(N)=O)cc3)ccc21

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.54
CYP26A1 O43174 4/20 0.48
RXRA P19793 3/20 0.46
RXRB P28702 3/20 0.46
RXRG P48443 3/20 0.46
PARP10 Q53GL7 1/20 0.45
CYP26B1 Q9NR63 3/20 0.44
CYP3A4 P08684 1/20 0.44

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
SCHEMBL8674842 0.83 RXRA (0.68) PPARGCYP26A1RXRARXRBRXRG
SCHEMBL8675471 0.82 MAOB (0.53) PPARG
SCHEMBL8677714 0.82 PPARG (0.53) PPARGCYP26A1RXRARXRBRXRG
SCHEMBL8676448 0.79 RARA (0.56) PPARGCYP26A1RXRARXRBRXRG
SCHEMBL9272893 0.79 MAOB (0.49) PPARGCYP26A1RXRARXRBRXRG
SCHEMBL8675711 0.78 PPARG (0.50) PPARGCYP26A1RXRARXRBRXRG
SCHEMBL8674612 0.76 MAOB (0.56) PPARGCYP3A4
SCHEMBL10435472 0.75 PPARG (0.47) PPARGCYP26A1RXRARXRBRXRG
SCHEMBL1395785 0.75 PARP10 (0.68) PARP10
SCHEMBL8676840 0.75 RXRB (0.71) CYP26A1RXRARXRBRXRGCYP26B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5739374-A Processes of preparing diphenylheteroalkyl derivatives BASF AKTIENGESELLSCHAFT (DE) 1998-04-14 US disclosed
US-5656619-A Diphenylheteroalkyl derivatives, the preparation thereof and drugs and cosmetics prepared therefrom BASF AKTIENGESELLSCHAFT (DE) 1997-08-12 US disclosed
US-5527945-A Diphenylheteroalkyl derivatives, the preparation thereof and drugs and cosmetics prepared therefrom BASF AKTIENGESELLSCHAFT (DE) 1996-06-18 US disclosed
US-5248823-A Diphenylheteroalkyl derivatives, the preparation thereof and drugs and cosmetics prepared therefrom BASF AKTIENGESELLSCHAFT (DE) 1993-09-28 US disclosed
US-5225601-A Sulfur containing compounds for skin disorders BASF AKTIENGESELLSCHAFT (DE) 1993-07-06 US disclosed