SCHEMBL38656346

SCHEMBL38656346

O=C(c1ccccc1)c1cccc(-n2c3ccccc3c3ccccc32)c1-n1c2ccccc2c2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.59
POLB P06746 3/20 0.48
AKR1C3 P42330 1/20 0.47
MYC P01106 2/20 0.47
ATM Q13315 2/20 0.45
HSP90AA1 P07900 1/20 0.45
PKM P14618 1/20 0.45
CCR6 P51684 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TLR9 Q9NR96 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
KMT2A Q03164 1/20 0.44
CDC25B P30305 1/20 0.42
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
P2RX4 Q99571 1/20 0.41
RORC P51449 1/20 0.39
SRC P12931 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39

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
SCHEMBL17850892 0.87 ALDH1A1 (0.72) ALDH1A1POLBAKR1C3MYCATM
SCHEMBL17850891 0.82 ALDH1A1 (0.69) ALDH1A1POLBAKR1C3MYCATM
SCHEMBL17850961 0.81 ALDH1A1 (0.63) ALDH1A1POLBAKR1C3MYCATM
SCHEMBL17850972 0.81 ALDH1A1 (0.57) ALDH1A1POLBAKR1C3ATMHSP90AA1
SCHEMBL17850957 0.77 ALDH1A1 (0.57) ALDH1A1POLBAKR1C3MYCATM
SCHEMBL3796004 0.76 ALDH1A1 (0.52) ALDH1A1POLBATMNPSR1TDP1
SCHEMBL28379187 0.76 ALDH1A1 (0.59) ALDH1A1POLBAKR1C3MYCATM
SCHEMBL27907073 0.76 ALDH1A1 (0.59) ALDH1A1POLBAKR1C3MYCATM
SCHEMBL28702397 0.75 ALDH1A1 (0.68) ALDH1A1POLBMYCATMCDC25B
SCHEMBL30175514 0.75 ALDH1A1 (1.00) ALDH1A1POLBAKR1C3MYCATM

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
CN-122037606-A Triarylmethane dye and application thereof 阜阳欣奕华新材料科技股份有限公司 2026-05-15 CN disclosed