SCHEMBL31592891

SCHEMBL31592891

Clc1cc2[nH]c(-c3cccc(Nc4ncc(-c5ccccn5)cn4)c3)nc2cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.46
▸ CBFB Q13951 7/20 0.43
▸ METAP2 P50579 5/20 0.43
▸ METAP1 P53582 5/20 0.43
▸ NPC1 O15118 4/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ KDR P35968 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ MET P08581 1/20 0.40
▸ NR2E3 Q9Y5X4 1/20 0.40
▸ CHEK2 O96017 1/20 0.39
▸ SCD O00767 1/20 0.39

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
SCHEMBL27040307 1.00 SYK (0.46) SYKCBFBMETAP2METAP1NPC1
SCHEMBL31592820 0.89 SYK (0.47) SYKCBFBMETAP2METAP1NPC1
SCHEMBL31592830 0.89 KDR (0.45) SYKCBFBMETAP2METAP1NPC1
SCHEMBL31592935 0.88 CHEK2 (0.42) SYKCBFBMETAP2METAP1NPC1
SCHEMBL31592855 0.88 METAP2 (0.60) SYKCBFBMETAP2METAP1NPC1
SCHEMBL27039954 0.87 METAP2 (0.47) SYKCBFBMETAP2METAP1NPC1
SCHEMBL31592811 0.87 METAP2 (0.47) SYKCBFBMETAP2METAP1NPC1
SCHEMBL31592949 0.86 KDM4E (0.53) SYKMETAP2METAP1NPC1KDM4E
SCHEMBL27039994 0.86 KDM4E (0.53) SYKMETAP2METAP1NPC1KDM4E
SCHEMBL31592802 0.86 SYK (0.45) SYKCBFBMETAP2METAP1NPC1

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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