SCHEMBL20071771

SCHEMBL20071771

N#Cc1ccc2cc(N3c4ccccc4N(c4ccc5cc(C#N)ccc5c4)C3C3N(c4ccc5cc(C#N)ccc5c4)c4ccccc4N3c3ccc4cc(C#N)ccc4c3)ccc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
F2 P00734 1/20 0.38
PLG P00747 1/20 0.38
PLAU P00749 1/20 0.38
KLKB1 P03952 1/20 0.38
PRSS1 P07477 1/20 0.38
CYP17A1 P05093 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
CYP19A1 P11511 1/20 0.36
SLC6A2 P23975 5/20 0.35
SLC6A4 P31645 5/20 0.35
SLC6A3 Q01959 3/20 0.35
TDP2 O95551 3/20 0.34
IMPDH2 P12268 1/20 0.34
IMPDH1 P20839 1/20 0.34
HSP90AA1 P07900 1/20 0.34
CYP2A6 P11509 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL17786071 0.81 HSP90AA1 (0.46) CA1CA2CYP11B1CYP11B2CYP19A1
SCHEMBL20071959 0.79 HSP90AA1 (0.40) CYP11B1CYP11B2CYP19A1SLC6A2SLC6A4
SCHEMBL19343000 0.79 HSP90AA1 (0.42) CA1CA2F2PLGPLAU
SCHEMBL20072022 0.75 CYP2A6 (0.50) HSP90AA1CYP2A6ALDH1A1GAAHTR3A
SCHEMBL20071828 0.75 CYP1A2 (0.50) CYP11B1CYP11B2CYP19A1SLC6A2SLC6A4
Water SCHEMBL1898776 0.72 CA1 (0.59) CA1CA2F2PLGPLAU
SCHEMBL60579 0.72 CA1 (0.59) CA1CA2F2PLGPLAU
SCHEMBL31150958 0.72 CA1 (0.59) CA1CA2F2PLGPLAU
SCHEMBL20071772 0.72 CYP1A2 (0.53) CYP11B1CYP11B2CYP2A6KDM4EALDH1A1
SCHEMBL20072023 0.72 KCNH2 (0.38) ALDH1A1HTR3AKCNH2

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-10541260-B2 Organic photoelectric conversion element, optical area sensor, imaging device, and imaging apparatus CANON KABUSHIKI KAISHA (JP) 2020-01-21 US disclosed
US-20180108691-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT, OPTICAL AREA SENSOR, IMAGING DEVICE, AND IMAGING APPARATUS CANON KABUSHIKI KAISHA (JP) 2018-04-19 US disclosed