SCHEMBL24133261

SCHEMBL24133261

COc1cc2nc(I)oc2cc1OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.42
MCL1 Q07820 1/20 0.42
ALOX5 P09917 1/20 0.39
CTSG P08311 1/20 0.38
KLK7 P49862 1/20 0.38
KLK14 Q9P0G3 1/20 0.38
KLK5 Q9Y337 1/20 0.38
KDM4E B2RXH2 4/20 0.38
POLB P06746 1/20 0.38
PGK1 P00558 3/20 0.38
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
ALDH1A1 P00352 3/20 0.38
NPC1 O15118 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KMT2A Q03164 2/20 0.36
C1R P00736 1/20 0.36
ELANE P08246 1/20 0.36
HTT P42858 1/20 0.36
TUBB4A P04350 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
SCHEMBL31430574 0.80 GAA (0.42) KDM4EALDH1A1NPC1KMT2AHTT
SCHEMBL31430578 0.80 GAA (0.42) KDM4EALDH1A1NPC1KMT2AHTT
SCHEMBL29878262 0.77 NQO2 (0.42) NQO2MCL1ALOX5KDM4EPOLB
SCHEMBL27038332 0.77 SMN1; SMN2 (0.44) NQO2MCL1ALOX5KDM4EPOLB
SCHEMBL11443102 0.77 NQO2 (0.42) NQO2MCL1ALOX5KDM4EPOLB
SCHEMBL12778280 0.74 APP (0.54) NQO2KDM4EPOLBALDH1A1NPC1
SCHEMBL22337709 0.72 L3MBTL1 (0.44) KDM4EPOLBALDH1A1NPC1SMN1; SMN2
SCHEMBL11173082 0.72 KMT2A (0.46) NQO2MCL1KDM4EPOLBPDGFRB
SCHEMBL24133257 0.71 AHR (0.41) ALDH1A1C1RHTT
SCHEMBL21168121 0.71 L3MBTL1 (0.43) KDM4EPOLBALDH1A1NPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11209582-B2 Composition, curable composition, cured film, near infrared cut filter, infrared transmitting filter, solid image pickup element, infrared sensor, and camera module FUJIFILM CORPORATION (JP) 2021-12-28 US disclosed