SCHEMBL4982048

SCHEMBL4982048

O=C(Nc1ccc(Cl)cc1)c1cccc2c1CCN(Cc1ccncc1)C2

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.61
NOD1 Q9Y239 5/20 0.59
TNF P01375 3/20 0.59
NOD2 Q9HC29 3/20 0.59
CARM1 Q86X55 1/20 0.51
P2RY1 P47900 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 2/20 0.48
USP2 O75604 1/20 0.48
TSHR P16473 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
RAB9A P51151 1/20 0.48
GPR52 Q9Y2T5 1/20 0.46

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
SCHEMBL14122641 0.92 CARM1 (0.60) KDRNOD1TNFNOD2CARM1
SCHEMBL14147238 0.90 KDR (0.53) KDRNOD1TNFNOD2CARM1
SCHEMBL9605547 0.88 KDR (0.70) KDRNOD1TNFNOD2CARM1
SCHEMBL14134955 0.88 NOD1 (0.53) KDRNOD1TNFNOD2CARM1
SCHEMBL9605558 0.85 KDR (0.53) KDRNOD1CARM1SMN1; SMN2KDM4E
SCHEMBL9605522 0.84 KDR (0.55) KDRNOD1TNFNOD2CARM1
SCHEMBL9605554 0.83 KDR (0.55) KDRNOD1TNFNOD2CARM1
SCHEMBL4439008 0.82 KDR (0.80) KDRNOD1TNFNOD2CARM1
SCHEMBL9606024 0.81 KDR (0.53) KDRNOD1TNFNOD2CARM1
SCHEMBL9605898 0.81 PTPN1 (0.49) P2RY1SMN1; SMN2KDM4ELMNAUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338455-B2 Pyridines or pyrimidines having 4-(hydrogenated 1-pyridyl- or hydrogenated 1-isoquinolyl rings, e.g., N-(4-chlorophenyl)-2-(pyridin-4-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-5-carboxamide; kinase inhibitors; inflammation, angiogenesis and cancer AMGEN INC. (US) 2012-12-25 US disclosed
US-8338455-B2 Pyridines or pyrimidines having 4-(hydrogenated 1-pyridyl- or hydrogenated 1-isoquinolyl rings, e.g., N-(4-chlorophenyl)-2-(pyridin-4-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-5-carboxamide; kinase inhibitors; inflammation, angiogenesis and cancer AMGEN INC. (US) 2012-12-25 US disclosed
US-8338455-B2 Pyridines or pyrimidines having 4-(hydrogenated 1-pyridyl- or hydrogenated 1-isoquinolyl rings, e.g., N-(4-chlorophenyl)-2-(pyridin-4-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-5-carboxamide; kinase inhibitors; inflammation, angiogenesis and cancer AMGEN INC. (US) 2012-12-25 US disclosed
EP-2118088-B1 Heterocyclic compounds and their use in treating inflammation, angiogenesis and cancer AMGEN INC (US) 2012-05-30 EP disclosed
EP-2118088-B1 Heterocyclic compounds and their use in treating inflammation, angiogenesis and cancer AMGEN INC (US) 2012-05-30 EP disclosed
US-20080161346-A1 Compounds and methods of use AMGEN INC. (US) 2008-07-03 US disclosed
US-20080161346-A1 Compounds and methods of use AMGEN INC. (US) 2008-07-03 US disclosed
US-20080161346-A1 Compounds and methods of use AMGEN INC. (US) 2008-07-03 US disclosed
WO-2008079292-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE IN TREATING INFLAMMATION, ANGIOGENESIS AND CANCER AMGEN INC. (US) 2008-07-03 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-20080161346-A1 Compounds and methods of use VHL, VEGFA, FLT1 KDR 6/4885NOD1 674/4885TNF 75/4885

“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.