SCHEMBL5607909

SCHEMBL5607909

CC(C)(C)c1ccc(O)c(C(C)(C)C)c1.CC(C)(C)c1ccc(O)c(C(C)(C)C)c1.OCC(CO)(COP(O)O)COP(O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
ALOX15 P16050 3/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NR1I2 O75469 1/20 0.40
LMNA P02545 1/20 0.40
CYP2C9 P11712 1/20 0.40
MIF P14174 1/20 0.40
TYR P14679 1/20 0.40
HTT P42858 1/20 0.40
NFE2L2 Q16236 1/20 0.40
MAPT P10636 4/20 0.38
GAA P10253 3/20 0.38
MEN1 O00255 1/20 0.38
PKM P14618 1/20 0.38
RECQL P46063 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP2D6 P10635 2/20 0.37
HSP90AA1 P07900 2/20 0.37

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
SCHEMBL29160858 0.85 ALDH1A1 (0.48) ALDH1A1ALOX15HSD17B10HPGDTDP1
SCHEMBL8928288 0.84 TRPV1 (0.39) ALDH1A1ALOX15HSD17B10LMNAHTT
SCHEMBL28710912 0.83 ALDH1A1 (0.53) ALDH1A1ALOX15HSD17B10HPGDTDP1
SCHEMBL25382540 0.83 ALDH1A1 (0.53) ALDH1A1ALOX15HSD17B10HPGDTDP1
SCHEMBL466221 0.83 ALDH1A1 (0.53) ALDH1A1ALOX15HSD17B10HPGDTDP1
SCHEMBL7081344 0.81 TRPV1 (0.39) ALDH1A1ALOX15HSD17B10LMNAHTT
SCHEMBL29431941 0.80 ALDH1A1 (0.53) ALDH1A1ALOX15HSD17B10HPGDTDP1
SCHEMBL597699 0.78 ALDH1A1 (0.59) ALDH1A1ALOX15HSD17B10HPGDTDP1
SCHEMBL8845948 0.78 ALDH1A1 (0.59) ALDH1A1ALOX15HSD17B10HPGDTDP1
SCHEMBL1134579 0.78 ALDH1A1 (0.59) ALDH1A1ALOX15HSD17B10HPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1831308-A1 THERMOPLASTIC POLYCARBONATE COMPOSITIONS, ARTICLES MADE THEREFROM AND METHOD OF MANUFACTURE General Electric Company (US) 2007-09-12 EP disclosed
WO-2006071488-A1 THERMOPLASTIC POLYCARBONATE COMPOSITIONS, ARTICLES MADE THEREFROM AND METHOD OF MANUFACTURE GENERAL ELECTRIC COMPANY (US) 2006-07-06 WO disclosed
US-20060142486-A1 Thermoplastic polycarbonate compositions, articles made therefrom and method of manufacture CITIBANK, N.A., AS COLLATERAL AGENT 2006-06-29 US disclosed