SCHEMBL5429490

SCHEMBL5429490

Cc1ccc(C(=O)NC(C)C)cn1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.66
HDAC6 Q9UBN7 1/20 0.66
GRM5 P41594 1/20 0.55
KDM4E B2RXH2 2/20 0.54
PRKAB2 O43741 1/20 0.52
PRKAG1 P54619 1/20 0.52
PRKAA2 P54646 1/20 0.52
PRKAA1 Q13131 1/20 0.52
PRKAG3 Q9UGI9 1/20 0.52
PRKAG2 Q9UGJ0 1/20 0.52
PRKAB1 Q9Y478 1/20 0.52
MAPT P10636 2/20 0.50
HPGD P15428 1/20 0.50
MLYCD O95822 1/20 0.49
HPGDS O60760 1/20 0.48
XDH P47989 2/20 0.47
ALDH1A1 P00352 2/20 0.46
NPC1 O15118 1/20 0.46
GABRA5 P31644 2/20 0.45
GSK3B P49841 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
SCHEMBL24011654 0.86 HDAC1 (0.62) HDAC1HDAC6GRM5KDM4EPRKAB2
SCHEMBL5429428 0.83 HDAC1 (0.58) HDAC1HDAC6KDM4EPRKAB2PRKAG1
SCHEMBL5423446 0.83 HPGD (0.58) HDAC1HDAC6KDM4EPRKAB2PRKAG1
SCHEMBL13164714 0.82 GRM5 (0.56) GRM5KDM4EMLYCDHPGDSXDH
SCHEMBL5420363 0.81 ALDH1A1 (0.60) HDAC1HDAC6KDM4EPRKAB2PRKAG1
SCHEMBL5782817 0.81 HDAC1 (0.55) HDAC1HDAC6KDM4EPRKAB2PRKAG1
SCHEMBL9989282 0.81 HDAC1 (0.51) HDAC1HDAC6KDM4EHPGDALDH1A1
SCHEMBL7453238 0.81 HDAC1 (0.51) HDAC1HDAC6KDM4EHPGDALDH1A1
SCHEMBL6870509 0.81 LMNA (0.60) GRM5MAPTALDH1A1NPC1LMNA
SCHEMBL21401430 0.81 GRM5 (0.54) HDAC1HDAC6GRM5MAPTHPGD

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 16 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-A9 METHOD OF INHIBITING ANGIOGENESIS ABBOTT LAB (US) 2004-05-27 WO 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-20230348369-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-11-02 US disclosed
WO-2022140428-A2 INHIBITORS OF PEPTIDYLARGININE DEIMINASES GILEAD SCIENCES, INC. (US) 2022-06-30 WO disclosed
WO-2016137506-A1 PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS AND THEIR THERAPEUTICAL APPLICATIONS NANTBIOSCIENCE, INC. (US) 2016-09-01 WO disclosed
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-A9 METHOD OF INHIBITING ANGIOGENESIS ABBOTT LAB (US) 2004-05-27 WO 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 (4 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 HDAC1 439/4885HDAC6 411/4885GRM5 2316/4885
US-20230348369-A1 NAMPT MODULATORS NAMPT, NNT, NAPRT HDAC1 51/4885HDAC6 121/4885GRM5 3035/4885
US-20070043089-A1 METHOD OF INHIBITING ANGIOGENESIS PGF, VEGFA, FLT4 HDAC1 439/4885HDAC6 411/4885GRM5 2316/4885
US-20040067985-A1 Method of inhibiting angiogenesis VEGFA, PGF, FLT4 HDAC1 411/4885HDAC6 742/4885GRM5 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.