SCHEMBL18005117

SCHEMBL18005117

N#Cc1[nH]nnc1-c1nc(-c2ccc(F)c(Cl)c2)cs1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 1/20 0.42
▸ EIF4E P06730 14/20 0.39
▸ RAB9A P51151 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ UCHL1 P09936 1/20 0.38
▸ USP30 Q70CQ3 1/20 0.38
▸ NPC1 O15118 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 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
SCHEMBL16399551 0.91 EIF4E (0.39) ABL1EIF4EUCHL1USP30
SCHEMBL18005195 0.86 RAB9A (0.49) RAB9AKDM4EALDH1A1MAPK1NPC1
SCHEMBL18005026 0.82 EIF4E (0.39) ABL1EIF4E
SCHEMBL16399594 0.81 EIF4E (0.48) ABL1EIF4ERAB9AKDM4ENPC1
SCHEMBL18005013 0.81 RAB9A (0.44) EIF4ERAB9AKDM4EALDH1A1MAPK1
SCHEMBL18006160 0.80 ADORA2A (0.39) —
SCHEMBL16399142 0.79 KDM4E (0.49) RAB9AKDM4EALDH1A1NPC1MEN1
SCHEMBL18005038 0.79 GRM5 (0.35) —
SCHEMBL18005063 0.79 EIF4E (0.40) EIF4ERAB9AKDM4ENPC1
SCHEMBL18005951 0.78 TGFBR1 (0.39) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 — — EP disclosed
US-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 — — US disclosed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 — — US disclosed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 — — US 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 (2 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-10626095-B2 Cyanotriazole compounds CS, PC, ACAT1 ABL1 3292/4885EIF4E 2415/4885RAB9A 4775/4885
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS CS, PC, ACAT1 ABL1 3292/4885EIF4E 2415/4885RAB9A 4775/4885

“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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