SCHEMBL16007332

SCHEMBL16007332

O=C(Nc1cccc(Cl)c1)c1cccnc1N[C@@H]1CCCNC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 1/20 0.53
▸ CHEK1 O14757 6/20 0.50
▸ AURKA O14965 2/20 0.48
▸ RPS6KB1 P23443 2/20 0.48
▸ GRM4 Q14833 2/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.47
▸ GRM5 P41594 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ CDK2AP1 O14519 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45

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
SCHEMBL16007161 1.00 KDR (0.53) KDRCHEK1AURKARPS6KB1GRM4
SCHEMBL16007162 1.00 KDR (0.53) KDRCHEK1AURKARPS6KB1GRM4
SCHEMBL16007711 0.88 KDR (0.57) KDRGRM4HDAC6GRM5KMT2A
SCHEMBL16017725 0.82 KDR (0.51) KDRCHEK1GRM4HDAC6GRM5
SCHEMBL17399084 0.82 KDR (0.51) KDRCHEK1GRM4HDAC6GRM5
SCHEMBL17399083 0.82 KDR (0.51) KDRCHEK1GRM4HDAC6GRM5
SCHEMBL16007186 0.81 KDR (0.54) KDRGRM4HDAC6KMT2ANPC1
SCHEMBL16007616 0.80 KDR (0.53) KDRGRM4HDAC6GRM5KMT2A
SCHEMBL17399519 0.80 KDR (0.51) KDRGRM4HDAC6GRM5KMT2A
SCHEMBL16007567 0.79 KDR (0.50) KDRGRM4HDAC6GRM5NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9227955-B2 Compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2016-01-05 — — US claimed
US-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2014-09-11 — — US claimed
US-9227955-B2 Compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2016-01-05 — — US disclosed
US-9227955-B2 Compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2016-01-05 — — US disclosed
US-9227955-B2 Compound having angiogenesis inhibitory activity, method for preparing same, and pharmaceutical composition comprising same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2016-01-05 — — US disclosed
US-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same BORYUNG PHARMACEUTICAL CO., LTD. (KR) 2014-09-11 — — 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 (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-20140256711-A1 Novel Compound Having Angiogenesis Inhibitory Activity, Method for Preparing Same, and Pharmaceutical Composition Comprising Same VEGFA, EDF1, FLT1 KDR 4/4885CHEK1 4814/4885AURKA 3990/4885

“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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