SCHEMBL29958000

SCHEMBL29958000

CCOC(=O)c1nc(Cl)cc(OCc2cn3cc(C4CC4)ccc3n2)n1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 16/20 0.41
▸ METTL3 Q86U44 1/20 0.39
▸ TSHR P16473 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ POLB P06746 1/20 0.37

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
SCHEMBL27033420 1.00 KLKB1 (0.41) KLKB1METTL3TSHRKDM4EPOLB
SCHEMBL27033586 0.88 KLKB1 (0.40) KLKB1METTL3
SCHEMBL29958520 0.88 KLKB1 (0.40) KLKB1METTL3
SCHEMBL27033572 0.88 METTL3 (0.42) KLKB1METTL3KDM4E
SCHEMBL29957915 0.88 METTL3 (0.42) KLKB1METTL3KDM4E
SCHEMBL29958525 0.87 METTL3 (0.41) KLKB1METTL3
SCHEMBL27033584 0.87 METTL3 (0.41) KLKB1METTL3
SCHEMBL27033696 0.85 KLKB1 (0.41) KLKB1METTL3
SCHEMBL29958235 0.85 KLKB1 (0.41) KLKB1METTL3
SCHEMBL24737595 0.84 METTL3 (0.42) KLKB1METTL3

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-4308228-A1 PLASMA KALLIKREIN INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2024-01-24 — — EP disclosed
WO-2022197756-A1 PLASMA KALLIKREIN INHIBITORS SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2022-09-22 — — WO disclosed
Send feedback