SCHEMBL28520901

SCHEMBL28520901

Nc1ccc(-c2cc(-c3ccccc3)c(N)c(-c3ccccc3)c2N)cc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
HSD17B10 Q99714 5/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 5/20 0.40
KDM4E B2RXH2 3/20 0.40
GAA P10253 3/20 0.40
ALOX15 P16050 3/20 0.40
USP2 O75604 2/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
HSP90AA1 P07900 1/20 0.40
ALOX12 P18054 1/20 0.40
HTT P42858 1/20 0.40
KCNH2 Q12809 2/20 0.38
IKBKB O14920 3/20 0.36
CYP3A4 P08684 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
MAOA P21397 2/20 0.35

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
SCHEMBL5703627 0.89 MEN1 (0.43) MEN1KMT2ATDP1HSD17B10ALDH1A1
SCHEMBL18202989 0.82 MEN1 (0.56) MEN1KMT2ATDP1HSD17B10ALDH1A1
SCHEMBL30321470 0.81 MEN1 (0.46) MEN1KMT2ATDP1HSD17B10ALDH1A1
SCHEMBL29115742 0.80 HSD17B10 (0.48) MEN1KMT2ATDP1HSD17B10ALDH1A1
SCHEMBL30697354 0.80 HSD17B10 (0.48) MEN1KMT2ATDP1HSD17B10ALDH1A1
SCHEMBL21278695 0.78 HSD17B10 (0.44) MEN1KMT2ATDP1HSD17B10ALDH1A1
SCHEMBL26698709 0.78 MEN1 (0.52) MEN1KMT2ATDP1HSD17B10ALDH1A1
Hydrochloric Acid SCHEMBL1645389 0.76 MEN1 (0.45) MEN1KMT2ATDP1HSD17B10ALDH1A1
SCHEMBL530448 0.76 HSD17B10 (0.48) MEN1KMT2ATDP1HSD17B10ALDH1A1
Hydrochloric Acid SCHEMBL28480643 0.76 HSD17B10 (0.43) MEN1KMT2ATDP1HSD17B10ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113939554-A High-elasticity polyimide film and flexible metal foil laminated plate comprising same 聚酰亚胺先端材料有限公司 2022-01-14 CN disclosed
CN-112399984-A Polyimide film containing clay particles and carbon black and preparation method thereof 聚酰亚胺先端材料有限公司 2021-02-23 CN disclosed