SCHEMBL30746429

SCHEMBL30746429

Cc1c(Cc2ccnc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)c2F)cncc1Nc1ccc(Br)cc1F

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.37
AAK1 Q2M2I8 4/20 0.35
SSTR4 P31391 1/20 0.33
MAP2K1 Q02750 5/20 0.33
ABCB11 O95342 1/20 0.33
NQO2 P16083 1/20 0.33
MAP2K2 P36507 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
GAA P10253 1/20 0.32
EGFR P00533 6/20 0.32
KDR P35968 6/20 0.32

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
SCHEMBL26985087 1.00 FPR2 (0.37) FPR2AAK1SSTR4MAP2K1ABCB11
SCHEMBL26984982 0.96 FPR2 (0.36) FPR2AAK1SSTR4MAP2K1ABCB11
SCHEMBL30746395 0.93 KDR (0.35) FPR2AAK1MAP2K1ABCB11NQO2
SCHEMBL30746646 0.92 MKNK1 (0.34) AAK1SSTR4
SCHEMBL26984989 0.92 MKNK1 (0.34) AAK1SSTR4
SCHEMBL26985146 0.92 SYK (0.35) AAK1SSTR4MAP2K1MAP2K2HDAC3
SCHEMBL26985070 0.90 NUDT1 (0.40) AAK1MAP2K1KDR
SCHEMBL30746399 0.89 MAP2K2 (0.33) MAP2K1MAP2K2
SCHEMBL30746634 0.89 BRAF (0.34) GAA
SCHEMBL26984940 0.89 BRAF (0.34) GAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120129678-A Mitogen-activated protein kinase (MEK) inhibitors 耐斯泰德医疗公司 2025-06-10 CN disclosed
EP-4551558-A2 MITOGEN-ACTIVATED PROTEIN KINASE (MEK) INHIBITORS Nested Therapeutics, Inc. (US) 2025-05-14 EP disclosed
WO-2024010925-A2 MITOGEN-ACTIVATED PROTEIN KINASE (MEK) INHIBITORS NESTED THERAPEUTICS, INC. (US) 2024-01-11 WO disclosed