SCHEMBL5444397

SCHEMBL5444397

Cc1cccc(CNCC(O)CNC(=O)O)c1C

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.45
DNM1 Q05193 1/20 0.44
BCHE P06276 7/20 0.43
P2RX7 Q99572 2/20 0.41
PDCD1LG2 Q9BQ51 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
PSMB1 P20618 1/20 0.40
PSMB5 P28074 1/20 0.40
PSMB2 P49721 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL935059 0.80 HPGD (0.54) KDM4CP2RX7PSMB1PSMB5PSMB2
SCHEMBL5444425 0.79 SMN1; SMN2 (0.51) DNM1BCHEP2RX7PDCD1LG2CD274
SCHEMBL4294535 0.75 KDM4C (0.48) KDM4CP2RX7CD274ALDH1A1HPGD
SCHEMBL18076397 0.74 DNM1 (0.56) DNM1BCHEALDH1A1HPGD
SCHEMBL7617265 0.73 BCHE (0.55) BCHEPSMB1PSMB5PSMB2
SCHEMBL7617259 0.73 BCHE (0.55) BCHEPSMB1PSMB5PSMB2
SCHEMBL5437755 0.72 BCHE (0.48) BCHE
SCHEMBL5670334 0.72 P2RX7 (0.52) KDM4CP2RX7ALDH1A1HPGD
SCHEMBL5433210 0.70 OPRK1 (0.51) ALDH1A1
SCHEMBL3351750 0.70 F2 (0.46) DNM1BCHEPSMB1PSMB5PSMB2

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-20070213407-A1 Compounds to treat Alzheimer's disease ELAN PHARMACEUTICALS AND PHARMACIA & UPJOHN COMPANY LLC 2007-09-13 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-20070213407-A1 Compounds to treat Alzheimer's disease PSEN2, PSEN1, CHAT KDM4C 2130/4885DNM1 1107/4885BCHE 8/4885

“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.