SCHEMBL31592966

SCHEMBL31592966

Fc1ccc2nc(-c3cccc(Nc4ncc(-c5ncccn5)cn4)c3)[nH]c2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 1/20 0.57
▸ KDR P35968 7/20 0.52
▸ BACE1 P56817 5/20 0.50
▸ MET P08581 2/20 0.49
▸ METAP2 P50579 1/20 0.49
▸ METAP1 P53582 1/20 0.49
▸ CBFB Q13951 1/20 0.49
▸ RET P07949 1/20 0.45
▸ BACE2 Q9Y5Z0 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ KIT P10721 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ HTT P42858 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
SCHEMBL31592897 0.89 CBFB (0.61) CYP11B1KDRBACE1METMETAP2
SCHEMBL31592889 0.88 KDM4E (0.55) KDRKDM4EALDH1A1HPGDMEN1
SCHEMBL31592895 0.88 DGAT1 (0.56) KDRCBFBKIT
SCHEMBL27039941 0.85 CYP11B1 (0.55) CYP11B1KDRBACE1METMETAP2
SCHEMBL31592913 0.85 CYP11B1 (0.55) CYP11B1KDRBACE1METMETAP2
SCHEMBL31592838 0.81 KDR (0.48) CYP11B1KDRBACE1METMETAP2
SCHEMBL31592917 0.79 NPBWR1 (0.55) CYP11B1KDRMETCBFBKIT
SCHEMBL31592807 0.79 KDR (0.52) KDRMETMETAP2KDM4EALDH1A1
SCHEMBL31592929 0.79 CBFB (0.62) CYP11B1KDRBACE1METMETAP2
SCHEMBL27040196 0.79 CBFB (0.58) CYP11B1KDRBACE1METMETAP2

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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