SCHEMBL25870993

SCHEMBL25870993

Clc1cc(Nc2ccc(-c3ccccc3)cc2)cc(Nc2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.50
ALDH1A1 P00352 4/20 0.48
MAPT P10636 4/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
AR P10275 1/20 0.48
HSD17B10 Q99714 3/20 0.48
ALOX12 P18054 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
PTGS1 P23219 1/20 0.48
SLC6A2 P23975 1/20 0.48
MAPK1 P28482 1/20 0.48
PTGS2 P35354 1/20 0.48
HTR2B P41595 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
PGR P06401 1/20 0.47
CNR1 P21554 3/20 0.44
EPHX2 P34913 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
SCHEMBL5345168 0.89 ALDH1A1 (0.60) CYP1A2ALDH1A1MAPTMEN1KMT2A
SCHEMBL21234546 0.85 ALDH1A1 (0.55) CYP1A2ALDH1A1MAPTMEN1KMT2A
SCHEMBL22182573 0.85 CYP1A2 (0.71) CYP1A2ALDH1A1MAPTHSD17B10ALOX12
SCHEMBL26204670 0.84 ALDH1A1 (0.56) CYP1A2ALDH1A1MAPTMEN1KMT2A
SCHEMBL3170386 0.82 HSD17B10 (0.60) CYP1A2ALDH1A1MAPTMEN1KMT2A
SCHEMBL428698 0.82 ALDH1A1 (0.71) CYP1A2ALDH1A1MAPTMEN1KMT2A
SCHEMBL21514977 0.82 ALDH1A1 (0.71) CYP1A2ALDH1A1MAPTMEN1KMT2A
SCHEMBL10034432 0.82 ALDH1A1 (0.71) CYP1A2ALDH1A1MAPTMEN1KMT2A
SCHEMBL5370467 0.82 ALDH1A1 (0.71) CYP1A2ALDH1A1MAPTMEN1KMT2A
SCHEMBL68489 0.82 ALDH1A1 (0.71) CYP1A2ALDH1A1MAPTMEN1KMT2A

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-20230232715-A1 LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO LTD (KR) 2023-07-20 US disclosed