SCHEMBL9876293

SCHEMBL9876293

CCCc1cc2cc(C(C)C)cccc-2c1CC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
RXRA P19793 2/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
PPARG P37231 6/20 0.33
PPARA Q07869 6/20 0.33
KDM4E B2RXH2 2/20 0.33
TSHR P16473 1/20 0.33
HDAC4 P56524 2/20 0.33
HDAC8 Q9BY41 2/20 0.33
MDM4 O15151 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
TYR P14679 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL9876281 0.85 CTSS (0.40) CTSSCTSKRXRARXRBRXRG
SCHEMBL9876472 0.81 ALOX5 (0.39) PPARGPPARAALOX5
SCHEMBL9876431 0.81 GCGR (0.37) CTSSCTSKPPARGPPARA
SCHEMBL9876214 0.81 GCGR (0.37) CTSSCTSKPPARGPPARA
SCHEMBL9876406 0.81 GCGR (0.37) CTSSCTSKPPARGPPARA
SCHEMBL9876192 0.81 GCGR (0.37) CTSSCTSKPPARGPPARA
SCHEMBL9876063 0.81 GCGR (0.37) CTSSCTSKPPARGPPARA
SCHEMBL9876309 0.80 CTSS (0.44) CTSSCTSKRXRARXRBRXRG
SCHEMBL9875663 0.76 RXRA (0.41) CTSSCTSKRXRARXRBRXRG
SCHEMBL9618739 0.72 RXRA (0.46) CTSSCTSKRXRARXRBRXRG

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-5037575-A Photostability MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1991-08-06 US disclosed