SCHEMBL31592913

SCHEMBL31592913

Fc1ccc2nc(-c3cccc(Nc4ncc(-c5cccnn5)cn4)c3)[nH]c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 1/20 0.55
▸ KDR P35968 6/20 0.48
▸ MET P08581 4/20 0.48
▸ METAP2 P50579 1/20 0.47
▸ METAP1 P53582 1/20 0.47
▸ CBFB Q13951 1/20 0.47
▸ BACE1 P56817 5/20 0.46
▸ KIT P10721 3/20 0.45
▸ RET P07949 1/20 0.44
▸ BACE2 Q9Y5Z0 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ POLB P06746 1/20 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
SCHEMBL27039941 1.00 CYP11B1 (0.55) CYP11B1KDRMETMETAP2METAP1
SCHEMBL31592884 0.90 KDR (0.46) CYP11B1KDRMETCBFBKIT
SCHEMBL31592832 0.89 KDM4E (0.53) KDRMETKDM4EALDH1A1HPGD
SCHEMBL31592788 0.89 DGAT1 (0.54) KDRCBFBKIT
SCHEMBL31592808 0.89 CYP11B1 (0.50) CYP11B1KDRMETMETAP2METAP1
SCHEMBL27040121 0.89 CYP11B1 (0.50) CYP11B1KDRMETMETAP2METAP1
SCHEMBL31592869 0.88 CYP11B1 (0.51) CYP11B1KDRMETMETAP2METAP1
SCHEMBL31592897 0.88 CBFB (0.61) CYP11B1KDRMETMETAP2METAP1
SCHEMBL27039859 0.88 CYP11B1 (0.51) CYP11B1KDRMETMETAP2METAP1
SCHEMBL31593093 0.87 NPC1 (0.51) KDRCBFBBACE1BACE2KDM4E

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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