SCHEMBL5365577

SCHEMBL5365577

Cc1cc(N)c(C)cc1N.Cc1cc(N)cc(C)c1N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.60
TSHR P16473 4/20 0.60
MAPK1 P28482 1/20 0.60
ALDH1A1 P00352 7/20 0.52
TDP1 Q9NUW8 4/20 0.52
TP53 P04637 2/20 0.52
CASP1 P29466 1/20 0.46
POLB P06746 2/20 0.44
ALOX15 P16050 2/20 0.42
CYP1A2 P05177 1/20 0.42
CASP7 P55210 1/20 0.42
HIF1A Q16665 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TERT O14746 1/20 0.41
CD44 P16070 2/20 0.40
GAA P10253 2/20 0.39
MAPT P10636 1/20 0.39
UHRF1 Q96T88 1/20 0.37
PDE10A Q9Y233 1/20 0.37
ATAD2 Q6PL18 1/20 0.37

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
SCHEMBL33589 0.88 ALDH1A1 (0.65) CYP3A4TSHRMAPK1ALDH1A1TDP1
Hydrochloric Acid SCHEMBL7931830 0.85 ALDH1A1 (0.61) CYP3A4TSHRMAPK1ALDH1A1TDP1
Hydrochloric Acid SCHEMBL970560 0.85 ALDH1A1 (0.61) CYP3A4TSHRMAPK1ALDH1A1TDP1
SCHEMBL10425169 0.82 ALDH1A1 (0.54) CYP3A4TSHRMAPK1ALDH1A1TDP1
SCHEMBL33943 0.82 CYP3A4 (0.86) CYP3A4TSHRMAPK1ALDH1A1TDP1
SCHEMBL29074595 0.80 CASP1 (0.77) CYP3A4TSHRMAPK1ALDH1A1TDP1
SCHEMBL30724395 0.80 CASP1 (0.48) CYP3A4TSHRMAPK1ALDH1A1TDP1
SCHEMBL21596963 0.80 ALDH1A1 (0.57) CYP3A4TSHRALDH1A1TDP1TP53
SCHEMBL9495198 0.80 CASP1 (0.48) CYP3A4TSHRMAPK1ALDH1A1TDP1
Hydrochloric Acid SCHEMBL8640327 0.78 CYP3A4 (0.80) CYP3A4TSHRMAPK1ALDH1A1TDP1

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-7273058-B2 Dividing hair into individual strands and winding on curlers; prior to application on hair, mixing shaping component with dye component having keratin-reducing agent and 4,5-diaminopyrazole and/or aminophenol derivative(s); fixing, rinsing WELLA AG (DE) 2007-09-25 US claimed
CN-116178953-A Polyimide film 住友化学株式会社 2023-05-30 CN disclosed
CN-115884995-A Film 住友化学株式会社 2023-03-31 CN disclosed