SCHEMBL993581

SCHEMBL993581

C=C(c1cccc(C(=O)Nc2ccc(Cl)cc2)c1)c1ccccn1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 3/20 0.64
▸ KCNK3 O14649 1/20 0.59
▸ KCNK9 Q9NPC2 1/20 0.59
▸ CES1 P23141 1/20 0.58
▸ GRM4 Q14833 5/20 0.56
▸ HDAC6 Q9UBN7 1/20 0.56
▸ AURKB Q96GD4 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ TLR7 Q9NYK1 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.51

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
SCHEMBL27540690 0.77 GRM4 (0.57) KDRKCNK3KCNK9CES1GRM4
SCHEMBL7401799 0.77 NPC1 (0.53) KDRKCNK3KCNK9CES1GRM4
SCHEMBL28790278 0.76 KDR (0.64) KDRKCNK3KCNK9GRM4HDAC6
SCHEMBL29289285 0.75 TLR7 (0.58) KDRCES1MEN1KMT2ATLR7
SCHEMBL993580 0.75 MEN1 (0.64) KDRKCNK3KCNK9CES1MEN1
SCHEMBL994629 0.75 MEN1 (0.64) KDRKCNK3KCNK9CES1MEN1
SCHEMBL27555176 0.75 MEN1 (0.64) KDRKCNK3KCNK9CES1MEN1
SCHEMBL9336728 0.74 KDM4E (0.55) KCNK3KCNK9GRM4KMT2AKDM4E
SCHEMBL994977 0.74 GRM5 (0.59) KDRCES1MEN1KMT2A
SCHEMBL3674558 0.74 KCNK3 (0.71) KCNK3KCNK9MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009447-A1 Substituted Benzoic Acid Amides and Use thereof for the Inhibition of Angiogenesis SCHERING AG (DE) 2011-01-13 — — 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-20110009447-A1 Substituted Benzoic Acid Amides and Use thereof for the Inhibition of Angiogenesis VEGFA, EGLN2, HIF1AN KDR 8/4885KCNK3 4720/4885KCNK9 4394/4885

“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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