SCHEMBL20207316

SCHEMBL20207316

NNC(=O)c1n[nH]c2ccc(F)cc12

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 11/20 0.51
DYRK1A Q13627 4/20 0.50
KDM4E B2RXH2 1/20 0.50
WNT1 P04628 1/20 0.50
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ALPL P05186 1/20 0.48

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
SCHEMBL12193634 0.84 KDM4E (0.53) DYRK1AKDM4EWNT1NPC1RAB9A
SCHEMBL28575862 0.83 NTRK1 (0.58) NTRK1DYRK1AWNT1
SCHEMBL15253767 0.82 RBP4 (0.46) NTRK1DYRK1AWNT1
SCHEMBL26204518 0.82 PDPK1 (0.58) DYRK1AKDM4E
SCHEMBL22518544 0.82 ROCK1 (0.53) DYRK1AKDM4ERAB9AALPL
SCHEMBL20207312 0.82 HDAC3 (0.54) DYRK1AKDM4EWNT1SMN1; SMN2
SCHEMBL956608 0.81 PRKAG1 (0.55) NTRK1DYRK1AKDM4EWNT1
SCHEMBL5945718 0.80 FLT3 (0.70) DYRK1AWNT1
SCHEMBL591699 0.80 RBP4 (0.45) NTRK1DYRK1AWNT1
SCHEMBL2536370 0.79 KDM4E (0.63) NTRK1DYRK1AKDM4ERAB9ASMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11046680-B1 Heteroaryl-substituted triazoles as APJ receptor agonists AMGEN INC. (US) 2021-06-29 US disclosed
US-11046680-B1 Heteroaryl-substituted triazoles as APJ receptor agonists AMGEN INC. (US) 2021-06-29 US disclosed
EP-3541805-B1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC (US) 2020-10-14 EP disclosed
EP-3541805-B1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC (US) 2020-10-14 EP disclosed
WO-2018097945-A1 HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS AMGEN INC. (US) 2018-05-31 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-11046680-B1 Heteroaryl-substituted triazoles as APJ receptor agonists AGTR1, AGTR2, TBXA2R NTRK1 941/4885DYRK1A 1074/4885KDM4E 4398/4885

“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.