SCHEMBL21764396

SCHEMBL21764396

Nc1ccc(C2=C3C(=O)NC(c4ccc(N)cc4)=C3C(=O)N2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
TDP2 O95551 1/20 0.41
BRD4 O60885 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
PTGS2 P35354 4/20 0.35
APP P05067 1/20 0.34
CYP19A1 P11511 2/20 0.33
DDB1 Q16531 1/20 0.33

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
SCHEMBL28975549 0.79 BRD4 (0.42) CYP3A4TDP1ALDH1A1TP53TDP2
SCHEMBL12424968 0.79 TGM2 (0.36) TDP2CA1CA2PTGS2METAP2
SCHEMBL16492050 0.77 PTGS2 (0.52) CYP3A4TDP1ALDH1A1TDP2HSD17B10
SCHEMBL1557038 0.77 HAO1 (0.43) ALDH1A1TDP2MEN1MAPTKMT2A
SCHEMBL12509900 0.77 PTGS2 (0.32) PTGS2
SCHEMBL91966 0.77 PTGS2 (0.50) ALDH1A1TDP2MAPTPTGS2
SCHEMBL7754290 0.77 PTGS2 (0.48) ALDH1A1TDP2PTGS2
SCHEMBL91967 0.77 PTGS2 (0.48) ALDH1A1TDP2PTGS2
SCHEMBL815442 0.77 PTGS2 (0.50) TDP1ALDH1A1HSD17B10MEN1KMT2A
SCHEMBL12424865 0.77 MAPT (0.41) TDP1ALDH1A1HSD17B10MEN1MAPT

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
US-20220413384-A1 PHOTOSENSITIVE COMPOSITION, FILM, OPTICAL FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2022-12-29 US disclosed
US-20210155803-A1 COLORING COMPOSITION, CURED FILM, METHOD FOR FORMING PATTERN, COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2021-05-27 US disclosed
WO-2020040043-A1 COLORING COMPOSITION, CURED FILM, PATTERN FORMATION METHOD, COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE 富士フイルム株式会社 2020-02-27 WO disclosed