SCHEMBL12848575

SCHEMBL12848575

Cc1cn(-c2ccc3c(c2)-c2ccc(NC(=O)c4c(F)cccc4F)cc2CN(C)C3)cn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LDLR P01130 2/20 0.42
▸ PCSK9 Q8NBP7 2/20 0.42
▸ MAPK13 O15264 1/20 0.41
▸ NR2E1 Q9Y466 3/20 0.39
▸ RAB9A P51151 4/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ GPR142 Q7Z601 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ MET P08581 1/20 0.38
▸ RORC P51449 1/20 0.38
▸ BRAF P15056 2/20 0.38
▸ PDGFRB P09619 1/20 0.38
▸ TP53 P04637 2/20 0.37
▸ USP30 Q70CQ3 1/20 0.37
▸ AURKA O14965 1/20 0.37
▸ RAF1 P04049 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
SCHEMBL12848860 0.71 SMN1; SMN2 (0.45) RAB9ANPC1SMN1; SMN2KDM4ERORC
SCHEMBL12796909 0.71 GPR142 (0.37) MAPK13NR2E1RAB9ANPC1SMN1; SMN2
SCHEMBL6804264 0.66 NR2E1 (0.52) LDLRPCSK9MAPK13NR2E1RAB9A
SCHEMBL12796745 0.65 NPC1 (0.46) RAB9ANPC1SMN1; SMN2GSK3BRORC
SCHEMBL14887579 0.65 IL2 (0.47) RAB9ANPC1SMN1; SMN2KDM4ETP53
SCHEMBL12848460 0.64 GPR142 (0.37) LDLRPCSK9MAPK13NR2E1GPR142
SCHEMBL3219333 0.63 MAPK14 (0.62) RAB9ANPC1SMN1; SMN2TP53
SCHEMBL12637985 0.62 CRACR2A (0.60) —
SCHEMBL3213028 0.61 MAPK14 (0.64) RAB9ANPC1SMN1; SMN2TP53
SCHEMBL3195053 0.61 MAPK14 (0.67) RAB9ANPC1SMN1; SMN2

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
US-20110052643-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2011-03-03 — — US disclosed
WO-2009089305-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2009-07-16 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110052643-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES TSLP, NFATC1, IL5 LDLR 1086/4885PCSK9 801/4885MAPK13 2378/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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