SCHEMBL31592829

SCHEMBL31592829

N#Cc1ccc2nc(-c3cccc(Nc4ccc(-c5cccnn5)cc4)c3)[nH]c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK1A1 P48729 8/20 0.53
▸ CSNK1D P48730 8/20 0.53
▸ CSNK1G2 P78368 7/20 0.53
▸ GSK3B P49841 7/20 0.53
▸ METAP2 P50579 1/20 0.49
▸ METAP1 P53582 1/20 0.49
▸ PKN1 Q16512 1/20 0.49
▸ PKN2 Q16513 1/20 0.49
▸ CHEK2 O96017 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ KIT P10721 1/20 0.41
▸ KDR P35968 4/20 0.41
▸ MET P08581 3/20 0.41

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
SCHEMBL31592996 0.87 NPC1 (0.51) METAP2METAP1KDM4EMEN1ALDH1A1
SCHEMBL27040145 0.85 ALDH1A1 (0.50) KDM4EMEN1ALDH1A1TP53POLB
SCHEMBL31593118 0.85 KDM4E (0.50) METAP2METAP1KDM4EMEN1ALDH1A1
SCHEMBL27039859 0.85 CYP11B1 (0.51) METAP2METAP1KDM4EMEN1ALDH1A1
SCHEMBL31592979 0.85 MEN1 (0.56) METAP2CHEK2KDM4EMEN1ALDH1A1
SCHEMBL31592872 0.85 MMP13 (0.48) KDM4EMEN1ALDH1A1TP53POLB
SCHEMBL31592962 0.85 ALDH1A1 (0.50) KDM4EMEN1ALDH1A1TP53POLB
SCHEMBL31592869 0.85 CYP11B1 (0.51) METAP2METAP1KDM4EMEN1ALDH1A1
SCHEMBL31593007 0.85 MEN1 (0.47) KDM4EMEN1ALDH1A1TP53POLB
SCHEMBL31592885 0.85 KDM4E (0.51) KDM4EMEN1ALDH1A1TP53POLB

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
EP-4559908-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF S2CBio Inc. (KR) 2025-05-28 — — EP claimed
EP-4559908-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF S2CBio Inc. (KR) 2025-05-28 — — EP disclosed
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