SCHEMBL28369905

SCHEMBL28369905

c1ccc(Nc2ccnnc2Nc2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 4/20 0.42
▸ TDP1 Q9NUW8 3/20 0.42
▸ GAA P10253 3/20 0.42
▸ MAPT P10636 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ GLA P06280 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ ABL1 P00519 2/20 0.42
▸ EGFR P00533 2/20 0.42
▸ DAPK3 O43293 1/20 0.42
▸ MAP4K4 O95819 1/20 0.42
▸ ERBB2 P04626 1/20 0.42
▸ PIM1 P11309 1/20 0.42
▸ PRKACA P17612 1/20 0.42
▸ LTK P29376 1/20 0.42
▸ MAPK8 P45983 1/20 0.42
▸ CSNK1A1 P48729 1/20 0.42
▸ RPS6KA3 P51812 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
SCHEMBL11822171 0.87 KDM4E (0.43) HSD17B10TDP1GAAMAPTKDM4E
SCHEMBL6194939 0.74 HSD17B10 (0.41) HSD17B10TDP1GAAMAPTKDM4E
SCHEMBL23486417 0.74 FABP4 (0.46) HSD17B10GAAMAPTKDM4EPIM1
SCHEMBL6689566 0.73 DHODH (0.58) HSD17B10TDP1GAAMAPTKDM4E
Hydrochloric Acid SCHEMBL14672810 0.72 DHODH (0.56) HSD17B10TDP1GAAMAPTKDM4E
SCHEMBL867461 0.71 MAPT (0.56) HSD17B10TDP1GAAMAPTKDM4E
SCHEMBL11823547 0.69 LMNA (0.43) GAAMAPTMEN1KMT2AERBB2
SCHEMBL23888750 0.69 HSD17B10 (0.55) HSD17B10TDP1GAAMAPTKDM4E
SCHEMBL2037022 0.69 DHODH (0.57) HSD17B10TDP1GAAMAPTKDM4E
Diphenylamine SCHEMBL29076233 0.69 HSD17B10 (0.63) HSD17B10TDP1GAAMAPTKDM4E

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-110862350-B Pterene pyridazine tetradentate platinum complex phosphorescent material and preparation method and application thereof 南京邮电大学 2022-02-01 — — CN disclosed
CN-110862350-A Pterene pyridazine tetradentate platinum complex phosphorescent material and preparation method and application thereof 南京邮电大学 2020-03-06 — — CN disclosed
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