SCHEMBL29673045

SCHEMBL29673045

Cc1cc(N)ccc1Cc1ccc(N)cc1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
MAPT P10636 5/20 0.54
TSHR P16473 3/20 0.54
GAA P10253 3/20 0.54
MAPK1 P28482 1/20 0.54
HTT P42858 1/20 0.54
PDE10A Q9Y233 1/20 0.50
CASP1 P29466 3/20 0.48
ALOX15 P16050 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP1A2 P05177 1/20 0.44
CASP7 P55210 1/20 0.44
HIF1A Q16665 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 2/20 0.43
THRB P10828 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL272096 1.00 ALDH1A1 (0.56) ALDH1A1MAPTTSHRGAAMAPK1
SCHEMBL20085335 0.89 TAAR1 (0.50) ALDH1A1MAPTTSHRGAAMAPK1
SCHEMBL31175768 0.87 ALDH1A1 (0.52) ALDH1A1MAPTTSHRGAAMAPK1
SCHEMBL578684 0.87 ALDH1A1 (0.52) ALDH1A1MAPTTSHRGAAMAPK1
SCHEMBL8005592 0.86 ALDH1A1 (0.44) ALDH1A1MAPTTSHRGAAMAPK1
SCHEMBL18469102 0.86 TSHR (0.47) ALDH1A1MAPTTSHRGAAMAPK1
SCHEMBL4556948 0.86 CYP3A4 (0.48) ALDH1A1MAPTTSHRGAAMAPK1
SCHEMBL15669917 0.86 ALDH1A1 (0.44) ALDH1A1MAPTTSHRGAAMAPK1
SCHEMBL865950 0.85 ALDH1A1 (0.56) ALDH1A1MAPTTSHRGAAMAPK1
SCHEMBL7743888 0.84 CYP19A1 (0.47) ALDH1A1MAPTTSHRGAAMAPK1

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
CN-114561053-A Composition for outer protective layer of power cable and power cable 穿越电缆集团有限公司 2022-05-31 CN claimed
CN-118638015-A Synthesis method of 3-substituted-4, 4' -methylenedianiline 常州市阳光药业有限公司 2024-09-13 CN disclosed
CN-114561053-A Composition for outer protective layer of power cable and power cable 穿越电缆集团有限公司 2022-05-31 CN disclosed