SCHEMBL7422382

SCHEMBL7422382

COC(=O)CC(N)c1cccc(F)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
KDM4E B2RXH2 1/20 0.45
AOC3 Q16853 1/20 0.44
MAPT P10636 2/20 0.43
POLB P06746 1/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43
CNR2 P34972 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
MTOR P42345 1/20 0.42
CFD P00746 1/20 0.41

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
SCHEMBL5633627 1.00 HDAC4 (0.46) HDAC4HDAC7HDAC5KDM4EAOC3
Hydrochloric Acid SCHEMBL6339453 0.98 HDAC4 (0.45) HDAC4HDAC7HDAC5KDM4EAOC3
SCHEMBL5720981 0.85 F2 (0.42) HDAC4HDAC7HDAC5AOC3MAPT
SCHEMBL7403590 0.85 MAPT (0.44) HDAC4HDAC7HDAC5MAPTPOLB
SCHEMBL5720988 0.85 MAPT (0.44) HDAC4HDAC7HDAC5MAPTPOLB
SCHEMBL25624041 0.85 KCNA5 (0.41) MAPTALDH1A1HTT
Hydrochloric Acid SCHEMBL7902491 0.84 MAPT (0.43) HDAC4HDAC7HDAC5MAPTPOLB
Hydrochloric Acid SCHEMBL7339173 0.84 MAPT (0.43) HDAC4HDAC7HDAC5MAPTPOLB
SCHEMBL17857566 0.84 HDAC4 (0.40) HDAC4HDAC7HDAC5AOC3MAPT
SCHEMBL3580558 0.83 KYNU (0.47) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021147699-A1 PYRIDOHETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2021-07-29 WO disclosed
US-20090149528-A1 Cinnamic acid amides BAYER HEALTHCARE AG (DE) 2009-06-11 US disclosed
US-20090149528-A1 Cinnamic acid amides BAYER HEALTHCARE AG (DE) 2009-06-11 US disclosed
US-7402683-B2 3-(1,3-benzodioxol-5-yl)-N-{(1S)-3-[((1S)-2-methyl-1-{[(3R,4S)-4-methyl-2,5-dioxo-3-pyrrolidinyl]carbonyl}propyl)amino]-3-oxo-1-phenylpropyl}-2-propenamide; bactericide, bacterial infection; septic infections, bone and joint infections, skin infections; veterinary medicine BAYER HEALTHCARE AG (DE) 2008-07-22 US disclosed
US-7402683-B2 3-(1,3-benzodioxol-5-yl)-N-{(1S)-3-[((1S)-2-methyl-1-{[(3R,4S)-4-methyl-2,5-dioxo-3-pyrrolidinyl]carbonyl}propyl)amino]-3-oxo-1-phenylpropyl}-2-propenamide; bactericide, bacterial infection; septic infections, bone and joint infections, skin infections; veterinary medicine BAYER HEALTHCARE AG (DE) 2008-07-22 US disclosed
EP-1501795-B1 CINNAMIC ACID AMIDES BAYER HEALTHCARE AG (DE) 2007-02-28 EP disclosed
EP-1240158-A1 1-(AMINOPHENYL)-2-PYRROLIDONES AS INTEGRIN INHIBITORS Amgen Inc., (US) 2002-09-18 EP disclosed
WO-2001044230-A1 1-(AMINOPHENYL)-2-PYRROLIDONES AS INTEGRIN INHIBITORS AMGEN INC. (US) 2001-06-21 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-20090149528-A1 Cinnamic acid amides PIGS, NISCH, PIGO HDAC4 172/4885HDAC7 130/4885HDAC5 35/4885

“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.