SCHEMBL5426735

SCHEMBL5426735

CCN(CC)C(=O)c1ccc(N2CCCC2C)nc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 3/20 0.42
▸ ADRA1A P35348 2/20 0.41
▸ GRM5 P41594 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ OPRD1 P41143 5/20 0.39
▸ OPRM1 P35372 3/20 0.39
▸ OPRK1 P41145 3/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ KLKB1 P03952 1/20 0.39
▸ KLK1 P06870 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL13885652 0.80 ADRA1A (0.41) ADRA1AALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL13450678 0.79 ADRA1A (0.42) ADRA1AALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL5909303 0.79 GAA (0.58) HRH3ADRA1AGRM5ALDH1A1HPGD
SCHEMBL2772647 0.78 HCAR3 (0.47) HRH3ADRA1AGRM5ALDH1A1RAB9A
SCHEMBL13885642 0.76 ADRA1A (0.46) HRH3ADRA1AALDH1A1RAB9ASMN1; SMN2
SCHEMBL5430879 0.76 DGAT2 (0.49) ADRA1AALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL26087754 0.73 HRH3 (0.49) HRH3ALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL26087751 0.73 HRH3 (0.49) HRH3ALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL20797592 0.72 KCNJ1 (0.42) KLKB1KLK1
SCHEMBL20798380 0.72 KCNJ1 (0.42) KLKB1KLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070032527-A1 METHOD OF INHIBITING ANGIOGENESIS HAVIV FORTUNA 2007-02-08 — — US claimed
EP-1551404-A2 METHOD OF INHIBITING ANGIOGENESIS Abbott Laboratories (US) 2005-07-13 — — EP claimed
US-20040116479-A1 Method of inhibiting angiogenesis ABBOTT LABORATORIES 2004-06-17 — — US claimed
WO-2004032908-A2 METHOD OF INHIBITING ANGIOGENESIS ABBOTT LABORATORIES (US) 2004-04-22 — — WO claimed
US-20040067985-A1 Method of inhibiting angiogenesis ABBOT LABORATORIES 2004-04-08 — — US claimed
US-20070043089-A1 METHOD OF INHIBITING ANGIOGENESIS HAVIV FORTUNA 2007-02-22 — — US disclosed
US-20070032527-A1 METHOD OF INHIBITING ANGIOGENESIS HAVIV FORTUNA 2007-02-08 — — US disclosed
EP-1551404-A2 METHOD OF INHIBITING ANGIOGENESIS Abbott Laboratories (US) 2005-07-13 — — EP disclosed
US-20040116479-A1 Method of inhibiting angiogenesis ABBOTT LABORATORIES 2004-06-17 — — US disclosed
WO-2004032908-A2 METHOD OF INHIBITING ANGIOGENESIS ABBOTT LABORATORIES (US) 2004-04-22 — — WO disclosed
US-20040067985-A1 Method of inhibiting angiogenesis ABBOT LABORATORIES 2004-04-08 — — 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 (3 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-20070032527-A1 METHOD OF INHIBITING ANGIOGENESIS PGF, VEGFA, FLT4 HRH3 3424/4885ADRA1A 2140/4885GRM5 2316/4885
US-20070043089-A1 METHOD OF INHIBITING ANGIOGENESIS PGF, VEGFA, FLT4 HRH3 3424/4885ADRA1A 2140/4885GRM5 2316/4885
US-20040067985-A1 Method of inhibiting angiogenesis VEGFA, PGF, FLT4 HRH3 3674/4885ADRA1A 1360/4885GRM5 2896/4885

“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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