SCHEMBL20375181

SCHEMBL20375181

COc1ccc(N(c2ccc(OC)c(OC)c2)c2ccc3c(c2)C2(c4cc(N(c5ccc(OC)c(OC)c5)c5ccc(OC)c(OC)c5)ccc4-3)c3cc(N(c4ccc(OC)c(OC)c4)c4ccc(OC)c(OC)c4)ccc3-c3ccc(N(c4ccc(OC)c(OC)c4)c4ccc(OC)c(OC)c4)cc32)cc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
NQO2 P16083 2/20 0.39
ACHE P22303 1/20 0.38
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35
TUBA1C Q9BQE3 1/20 0.35

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
SCHEMBL16625292 0.87 NQO2 (0.33) NQO2ACHEPOLBKDM4EPDGFRB
SCHEMBL233470 0.84 CA1 (0.39) CA2CA12CA1CA7CA9
SCHEMBL29350801 0.84 CA1 (0.39) CA2CA12CA1CA7CA9
SCHEMBL29349668 0.84 CA1 (0.39) CA2CA12CA1CA7CA9
SCHEMBL20370932 0.84 PDE4D (0.38) CA2CA12CA1CA7CA9
SCHEMBL23190650 0.84 TAS1R3 (0.35) CA2CA12CA1CA7CA9
SCHEMBL15497459 0.84 TAS1R3 (0.35) CA2CA12CA1CA7CA9
SCHEMBL8943682 0.83 CA2 (0.58) CA2CA12CA1CA7CA9
SCHEMBL22878581 0.83 CYP19A1 (0.37) NQO2ACHETUBB1ALDH1A1POLB
SCHEMBL18055641 0.81 EPHX2 (0.31) NQO2TUBB4ATUBBTUBA3CTUBA1B

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-10319533-B2 Photoelectric conversion element and solar cell RICOH COMPANY, LTD. (JP) 2019-06-11 US disclosed
US-20180197688-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR CELL RICOH COMPANY, LTD. (JP) 2018-07-12 US disclosed