SCHEMBL31494698

SCHEMBL31494698

CCc1ccc(C(=O)N(N)c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
HPGD P15428 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LIMK2 P53671 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 1/20 0.44
TAS2R14 Q9NYV8 1/20 0.43
PLK1 P53350 1/20 0.43
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
ESR1 P03372 1/20 0.42
ESR2 Q92731 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
SCHEMBL10949416 0.86 NPSR1 (0.50) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL11674054 0.84 TRPV1 (0.54) ALDH1A1HPGDPLK1HDAC1HDAC6
SCHEMBL29286008 0.84 ALDH1A1 (0.49) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL11675416 0.82 TRPV1 (0.55) ALDH1A1MEN1KMT2AMAPT
SCHEMBL407836 0.82 L3MBTL1 (0.50) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL11254594 0.81 CES2 (0.52) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL8355067 0.80 ADRA2C (0.49) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL18322326 0.80 CYP1A2 (0.53) SMN1; SMN2KMT2AMAPTHDAC1HDAC6
Hydrochloric Acid SCHEMBL11834225 0.79 CES2 (0.50) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL8986148 0.78 RAB9A (0.54) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A

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-119751462-A Benzotriazine diradical compound, preparation method and application thereof in organic resistive random access memory, near infrared detector and temperature control film 郑州大学 2025-04-04 CN disclosed