SCHEMBL19668043

SCHEMBL19668043

COc1cccc(OC)c1C(O)=Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.52
CA2 P00918 4/20 0.52
CA7 P43166 3/20 0.52
CA9 Q16790 3/20 0.52
CA12 O43570 2/20 0.52
CA14 Q9ULX7 2/20 0.52
NFE2L2 Q16236 3/20 0.47
TRPA1 O75762 1/20 0.47
CA4 P22748 1/20 0.44
TUBB1 Q9H4B7 2/20 0.42
TP53 P04637 2/20 0.42
TSHR P16473 1/20 0.42
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 1/20 0.42
TUBB3 Q13509 1/20 0.42
TUBB2A Q13885 1/20 0.42

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
SCHEMBL2092392 0.79 CA1 (0.59) CA1CA2CA7CA9CA12
SCHEMBL977479 0.72 MAPT (0.67) TP53CYP1B1KMT2AMEN1NPC1
SCHEMBL11752903 0.72 NFE2L2 (0.53) NFE2L2TRPA1TUBB1TP53TUBB4A
SCHEMBL977481 0.72 MAPT (0.67) TP53CYP1B1KMT2AMEN1NPC1
SCHEMBL18109191 0.71 CA2 (0.44) CA1CA2CA7CA9CA12
SCHEMBL7451319 0.70 CA12 (0.58) CA1CA2CA7CA9CA12
SCHEMBL7451323 0.70 CA12 (0.58) CA1CA2CA7CA9CA12
SCHEMBL574158 0.70 ESR1 (0.45) TRPA1TSHRALDH1A1CYP3A4
SCHEMBL8923377 0.69 NFE2L2 (0.52) CA1CA2CA7CA9CA12
SCHEMBL1225350 0.69 CA1 (0.62) CA1CA2CA7CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3463264-A1 METHOD FOR TREATING HAIR Kao Corporation (JP) 2019-04-10 EP disclosed
EP-3463267-A1 HAIR COSMETIC COMPOSITION Kao Corporation (JP) 2019-04-10 EP disclosed
EP-3463265-A1 HAIR COSMETIC COMPOSITION Kao Corporation (JP) 2019-04-10 EP disclosed
EP-3463266-A1 HAIR COSMETIC COMPOSITION Kao Corporation (JP) 2019-04-10 EP disclosed
WO-2017207767-A1 HAIR COSMETIC COMPOSITION KAO CORPORATION (JP) 2017-12-07 WO disclosed
WO-2017207768-A1 METHOD FOR TREATING HAIR KAO CORPORATION (JP) 2017-12-07 WO disclosed
WO-2017207799-A1 HAIR COSMETIC COMPOSITION KAO CORPORATION (JP) 2017-12-07 WO disclosed
WO-2017207786-A1 HAIR COSMETIC COMPOSITION KAO CORPORATION (JP) 2017-12-07 WO disclosed