SCHEMBL27976006

SCHEMBL27976006

COC1C=C(C(=O)c2ccccc2)C=CC1(OC)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.34
HPGD P15428 5/20 0.33
TSHR P16473 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
ELANE P08246 2/20 0.33
PTGS1 P23219 2/20 0.33
PTGS2 P35354 2/20 0.33
GAA P10253 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
AKR1C3 P42330 1/20 0.33
KDM4E B2RXH2 3/20 0.32
MAPT P10636 3/20 0.32
HSD17B10 Q99714 3/20 0.32
ALOX15 P16050 2/20 0.32
MAPK1 P28482 2/20 0.32
HTT P42858 2/20 0.32
LMNA P02545 3/20 0.32
F2 P00734 1/20 0.32

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
SCHEMBL27747728 0.82 ALDH1A1 (0.37) ALDH1A1HPGDTSHRNPC1RAB9A
SCHEMBL27620736 0.80 ALDH1A1 (0.35) ALDH1A1HPGDTSHRNPC1RAB9A
SCHEMBL27597829 0.80 ALDH1A1 (0.35) ALDH1A1HPGDTSHRNPC1RAB9A
SCHEMBL27702946 0.80 ALDH1A1 (0.35) ALDH1A1HPGDTSHRNPC1RAB9A
SCHEMBL2164754 0.68 ALDH1A1 (0.41) ALDH1A1HPGDTSHRNPC1RAB9A
SCHEMBL28552569 0.67 ALDH1A1 (0.39) ALDH1A1HPGDNPC1RAB9AELANE
SCHEMBL11227122 0.67 ALDH1A1 (0.39) ALDH1A1HPGDNPC1RAB9AELANE
SCHEMBL29183161 0.66 ALDH1A1 (0.38) ALDH1A1HPGDNPC1RAB9AELANE
SCHEMBL8624753 0.66 ALDH1A1 (0.38) ALDH1A1HPGDTSHRNPC1RAB9A
SCHEMBL210845 0.66 ALDH1A1 (0.38) ALDH1A1HPGDTSHRNPC1RAB9A

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
CN-101203582-B Ophthalmic devices comprising photochromic materials with extended pi-conjugated systems JOHNSON & JOHNSON VISION CARE, INC. (US) 2015-08-19 CN disclosed
CN-104130768-A Ophthalmic devices comprising photochromic materials having extended pi-conjugated systems JOHNSON & JOHNSON VISION CARE 2014-11-05 CN disclosed
CN-102667621-B Photochromic material TRANSITIONS OPTICAL INC 2014-08-13 CN disclosed