SCHEMBL658130

SCHEMBL658130

Clc1cc2ccncc2o1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 1/20 0.41
DYRK1A Q13627 1/20 0.41
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDO2 P48775 10/20 0.35
IDO1 P14902 4/20 0.35
NAMPT P43490 5/20 0.35
CYP2C9 P11712 1/20 0.35
GAA P10253 1/20 0.34
CYP2A6 P11509 1/20 0.34
CYP19A1 P11511 1/20 0.33

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
SCHEMBL16901677 0.75 NAMPT (0.40) DYRK1AKDM4EHTTTDO2IDO1
SCHEMBL19336862 0.75 NAMPT (0.35) DYRK1AKDM4EHTTNAMPTCYP2C9
SCHEMBL22791609 0.75 NAMPT (0.38) TDO2IDO1NAMPTCYP2C9CYP2A6
SCHEMBL18660625 0.75 HASPIN (0.35) KDM4ENPC1CYP1A2CYP2C19HTT
SCHEMBL1763648 0.75 NAMPT (0.35) DYRK1AKDM4EHTTNAMPTCYP2C9
SCHEMBL2629271 0.75 MAPT (0.51) DYRK1AKDM4ENPC1CYP1A2CYP2C19
SCHEMBL30770758 0.75 KDM4E (0.56) KDM4ENAMPTCYP2C9CYP2A6
SCHEMBL8627966 0.73 NPC1 (0.37) NPC1CYP2C19RAB9AIDO1NAMPT
SCHEMBL5955066 0.72 NPC1 (0.46) NPC1CYP2C19RAB9AIDO1NAMPT
SCHEMBL6343739 0.72 NAMPT (0.47) NPC1NAMPTCYP2C9

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-8378104-B2 7-aminofuropyridine derivatives OSI Pharmaceuticals, LLC (US) 2013-02-19 US disclosed
US-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2012-02-23 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 (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-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES MAP3K5, STK17A, MAPKAPK5 CDK9 232/4885DYRK1A 2154/4885KDM4E 117/4885

“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.