SCHEMBL18160752

SCHEMBL18160752

Cc1cccc(CNc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP1A2 P05177 1/20 0.38
TSHR P16473 1/20 0.38
HSP90AA1 P07900 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
HDAC6 Q9UBN7 2/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
NPSR1 Q6W5P4 2/20 0.34
HSD17B10 Q99714 1/20 0.34
SCN2A Q99250 2/20 0.34

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
SCHEMBL20024584 0.81 GAA (0.52) CYP3A4CYP2C9CYP2C19CYP1A2TSHR
SCHEMBL18157984 0.78 CYP3A4 (0.36) CYP3A4CYP2C9CYP2C19CYP1A2TSHR
SCHEMBL20031866 0.78 CYP2C9 (0.37) CYP3A4CYP2C9CYP2C19CYP1A2TSHR
SCHEMBL18157965 0.69 GAA (0.39) CYP3A4CYP2C9CYP2C19CYP1A2TSHR
SCHEMBL23793643 0.68 CA2 (0.46) CYP3A4CYP2C9CYP2C19CYP1A2TSHR
SCHEMBL10182817 0.68 MAPT (0.51) CYP3A4CYP2C9CYP2C19CYP1A2TSHR
SCHEMBL9901097 0.68 TSHR (0.48) CYP3A4CYP2C9CYP2C19CYP1A2TSHR
SCHEMBL394716 0.66 CA2 (0.45) CYP3A4CYP2C9CYP2C19CYP1A2TSHR
SCHEMBL29898194 0.66 TSHR (0.47) CYP3A4CYP2C9CYP2C19CYP1A2TSHR
SCHEMBL18646369 0.66 NR5A2 (0.53) CYP3A4CYP2C9CYP2C19CYP1A2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180094086-A1 NEAR INFRARED ABSORBING COMPOSITION, NEAR INFRARED CUT FILTER, METHOD OF MANUFACTURING NEAR INFRARED CUT FILTER, DEVICE, METHOD OF MANUFACTURING COPPER-CONTAINING POLYMER, AND COPPER-CONTAINING POLYMER FUJIFILM CORPORATION (JP) 2018-04-05 US disclosed
US-20160304730-A1 NEAR INFRARED RADIATION-ABSORBING COMPOSITION, NEAR INFRARED RADIATION CUT-OFF FILTER AND PRODUCTION METHOD THEREFOR, AND CAMERA MODULE AND PRODUCTION METHOD THEREFOR FUJIFILM CORPORATION (JP) 2016-10-20 US disclosed