SCHEMBL30746541

SCHEMBL30746541

CSc1nccc(Cc2cncc(Nc3ccc(F)cc3F)c2C)c1F

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SHMT2 P34897 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.31
▸ MAPT P10636 3/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ MAPK14 Q16539 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ CTDSP1 Q9GZU7 1/20 0.31
▸ PIK3C3 Q8NEB9 2/20 0.31
▸ GAA P10253 1/20 0.31
▸ CCNC P24863 1/20 0.31
▸ CDK8 P49336 1/20 0.31
▸ CACNA1B Q00975 1/20 0.30
▸ APBA1 Q02410 1/20 0.30
▸ RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL26984874 1.00 SHMT2 (0.32) SHMT2MAPK1ALDH1A1MAPTKDM4E
SCHEMBL26984916 0.90 NUDT1 (0.41) KMT2A
SCHEMBL30746457 0.90 CLK1 (0.34) MAPK1MAPTKMT2AL3MBTL1GAA
SCHEMBL30746438 0.90 NUDT1 (0.41) KMT2A
SCHEMBL26985184 0.90 CLK1 (0.34) MAPK1MAPTKMT2AL3MBTL1GAA
SCHEMBL26985336 0.85 DHFR (0.34) SHMT2MAPK1ALDH1A1KDM4EL3MBTL1
SCHEMBL30746604 0.85 DHFR (0.34) SHMT2MAPK1ALDH1A1KDM4EL3MBTL1
SCHEMBL30746363 0.82 PIK3C3 (0.35) SHMT2KMT2AMAPK14LMNAPIK3C3
SCHEMBL26985498 0.82 PIK3C3 (0.35) SHMT2KMT2AMAPK14LMNAPIK3C3
SCHEMBL30746450 0.79 RAF1 (0.43) ALDH1A1LMNAPIK3C3CACNA1BAPBA1

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
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