SCHEMBL29048614

SCHEMBL29048614

CCc1ccc(-c2cc(-c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)cc(-c3ccc(Cl)cc3)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.49
GAA P10253 2/20 0.49
SI P14410 2/20 0.49
MGAM2 Q2M2H8 2/20 0.49
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
MAPT P10636 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CTRC Q99895 2/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CHKA P35790 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
DHODH Q02127 2/20 0.38
HIF1A Q16665 1/20 0.38
ALOX12 P18054 1/20 0.37
RAD51 Q06609 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
SCHEMBL29048657 0.86 MGAM (0.49) MGAMGAASIMGAM2KMT2A
SCHEMBL25813859 0.85 MEN1 (0.51) MGAMGAASIMGAM2KMT2A
SCHEMBL11082722 0.85 MEN1 (0.51) MGAMGAASIMGAM2KMT2A
SCHEMBL21670565 0.83 NPSR1 (0.43) GAAKMT2AMEN1MAPTKDM4E
SCHEMBL24283674 0.81 CYP1A2 (0.42) KMT2AMEN1SMN1; SMN2KDM4EALDH1A1
SCHEMBL29048646 0.79 DHODH (0.36) GAAKMT2AMEN1MAPTSMN1; SMN2
SCHEMBL12533875 0.79 HCRTR2 (0.41) KDM4EALDH1A1TDP1L3MBTL1
SCHEMBL13152312 0.79 HCRTR2 (0.41) KDM4EALDH1A1TDP1L3MBTL1
SCHEMBL13241993 0.79 HCRTR2 (0.41) KDM4EALDH1A1TDP1L3MBTL1
SCHEMBL17735812 0.79 HCRTR2 (0.41) KDM4EALDH1A1TDP1L3MBTL1

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-110446770-B Reversible thermochromic composition and reversible thermochromic microcapsule pigment containing the same 百乐墨水株式会社 2023-08-08 CN disclosed