SCHEMBL9817034

SCHEMBL9817034

CC(C)(C)c1cc(Cc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)ccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.52
LMNA P02545 3/20 0.52
ALOX15 P16050 3/20 0.52
CYP2C9 P11712 2/20 0.52
TYR P14679 2/20 0.52
HTT P42858 2/20 0.52
NR1I2 O75469 1/20 0.52
MIF P14174 1/20 0.52
NFE2L2 Q16236 1/20 0.52
HSD17B10 Q99714 1/20 0.52
TSHR P16473 3/20 0.50
GAA P10253 2/20 0.50
CYP1A2 P05177 3/20 0.49
MAPK1 P28482 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
CYP3A4 P08684 2/20 0.49
BLM P54132 2/20 0.49
ATM Q13315 2/20 0.49
HIF1A Q16665 2/20 0.49

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
SCHEMBL2919862 0.92 ALDH1A1 (0.59) ALDH1A1LMNAALOX15CYP2C9TYR
SCHEMBL31146612 0.92 ALDH1A1 (0.59) ALDH1A1LMNAALOX15CYP2C9TYR
SCHEMBL29836278 0.92 ALDH1A1 (0.59) ALDH1A1LMNAALOX15CYP2C9TYR
SCHEMBL14680265 0.91 CA2 (0.61) ALDH1A1LMNAALOX15CYP2C9TYR
SCHEMBL9338699 0.88 ALDH1A1 (0.57) ALDH1A1LMNAALOX15CYP2C9TYR
SCHEMBL699786 0.88 HSPA5 (0.51) ALDH1A1LMNAALOX15CYP2C9TYR
SCHEMBL14608188 0.87 ALDH1A1 (0.50) ALDH1A1LMNAALOX15CYP2C9TYR
SCHEMBL39559 0.86 ALDH1A1 (0.63) ALDH1A1LMNAALOX15CYP2C9TYR
SCHEMBL526641 0.84 ALDH1A1 (0.61) ALDH1A1LMNAALOX15CYP2C9TYR
SCHEMBL7095183 0.84 ALDH1A1 (0.50) ALDH1A1LMNAALOX15CYP2C9TYR

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
EP-0453317-A2 Image forming medium CANON KABUSHIKI KAISHA (JP) 1991-10-23 EP disclosed
US-3992308-A Lubricating oil composition containing sulfurized reaction product of mixed tertiary alkyl phenols with formaldehyde ETHYL CORPORATION (US) 1976-11-16 US disclosed