SCHEMBL20912233

SCHEMBL20912233

Cc1c(F)ccnc1-c1ccn(C)n1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4A O75164 1/20 0.46
▸ KDM4B O94953 1/20 0.46
▸ KDM5B Q9UGL1 1/20 0.46
▸ JMJD6 Q6NYC1 11/20 0.41
▸ KMT2A Q03164 1/20 0.40
▸ SCN4A P35499 1/20 0.39
▸ KEAP1 Q14145 1/20 0.38
▸ CYP19A1 P11511 1/20 0.35
▸ TGFBR1 P36897 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ MAPK10 P53779 2/20 0.34

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
SCHEMBL26966622 0.81 KDM4A (0.44) KDM4AKDM4BKDM5BJMJD6KMT2A
SCHEMBL19480884 0.81 KEAP1 (0.44) KDM4AKDM4BKDM5BJMJD6KMT2A
SCHEMBL30509529 0.76 KMT2A (0.46) KDM4AKDM4BKDM5BJMJD6KMT2A
SCHEMBL22230356 0.72 KEAP1 (0.50) KDM4AKDM4BKDM5BJMJD6KMT2A
SCHEMBL16035670 0.71 KEAP1 (0.46) KDM4AKDM4BKDM5BJMJD6KMT2A
SCHEMBL18448976 0.70 KDM4A (0.44) KDM4AKDM4BKDM5BJMJD6KMT2A
SCHEMBL16561285 0.70 KMT2A (0.39) KDM4AKDM4BKDM5BJMJD6KMT2A
SCHEMBL38658394 0.70 S1PR2 (0.38) KDM4AKDM4BKDM5BJMJD6KMT2A
SCHEMBL38657463 0.70 KDM4A (0.39) KDM4AKDM4BKDM5BKMT2AKEAP1
SCHEMBL18157906 0.68 KMT2A (0.64) KDM4AKDM4BKDM5BJMJD6KMT2A

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-10738031-B2 N-[(heteroaryloxy)propanyl]heteroaryl carboxamides as antagonists of orexin subtype 1 receptor activity BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2020-08-11 — — US disclosed
US-20190112292-A1 NOVEL N-[(HETEROARYLOXY)PROPANYL]HETEROARYL CARBOXAMIDES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2019-04-18 — — 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-20190112292-A1 NOVEL N-[(HETEROARYLOXY)PROPANYL]HETEROARYL CARBOXAMIDES HCRTR2, HCRTR1, CNR2 KDM4A 2564/4885KDM4B 2481/4885KDM5B 2435/4885
US-10738031-B2 N-[(heteroaryloxy)propanyl]heteroaryl carboxamides as antagonists of orexin subtype 1 receptor activity HCRTR2, HCRTR1, CNR1 KDM4A 2995/4885KDM4B 3000/4885KDM5B 2697/4885

“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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