SCHEMBL13063790

SCHEMBL13063790

CCC(C)(CC)Oc1ccc(C(C)(C)c2ccc(OC(=O)C(C)C)c(Cl)c2)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.41
ALOX15 P16050 1/20 0.40
ACACB O00763 1/20 0.38
ADRB2 P07550 1/20 0.37
ADRA2A P08913 1/20 0.37
DRD2 P14416 1/20 0.37
ADRA2C P18825 1/20 0.37
DRD1 P21728 1/20 0.37
ADRA1A P35348 1/20 0.37
DRD3 P35462 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
GAA P10253 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL13063792 0.94 CYP2C19 (0.39) CYP2C19ALOX15ACACBADRB2ADRA2A
SCHEMBL13063794 0.85 ALOX15 (0.46) CYP2C19ALOX15ACACBADRB2ADRA2A
SCHEMBL13328519 0.85 VDR (0.42) ALOX15ADRB2ADRA2ADRD2ADRA2C
SCHEMBL13063789 0.85 ALOX15 (0.42) ALOX15ACACBADRB2ADRA2ADRD2
SCHEMBL13662195 0.82 RXRA (0.42) CYP2C19PPARDPPARARXRARXRB
SCHEMBL13758548 0.76 VDR (0.41) ALOX15ADRB2ADRA2ADRD2ADRA2C
SCHEMBL14679467 0.75 CYP2C19 (0.41) CYP2C19ACACBPPARDPPARARXRA
SCHEMBL13708508 0.75 VDR (0.40) KMT2AFBP1RORC
SCHEMBL13662194 0.73 ESR1 (0.44) PPARDPPARASMN1; SMN2KDM4EMEN1
SCHEMBL14407193 0.72 RXRA (0.42) CYP2C19PPARDPPARARXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100329748-A1 DEVELOPING DEVICE AND IMAGE FORMING APPARATUS USING THE DEVELOPING DEVICE RICOH COMPANY, LTD. (JP) 2010-12-30 US disclosed