SCHEMBL4386325

SCHEMBL4386325

NOCC1Cc2ccccc2N1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.44
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
ACE P12821 3/20 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
SCHEMBL4385549 0.82 ALOX5AP (0.43) NOTUMNPC1ALDH1A1CYP1A2CYP2C19
SCHEMBL4385547 0.82 ALOX5AP (0.43) NOTUMNPC1ALDH1A1CYP1A2CYP2C19
SCHEMBL7554164 0.81 DRD2 (0.53) NOTUMNPC1ALDH1A1CYP1A2CYP2C19
SCHEMBL30681441 0.81 DRD2 (0.53) NOTUMNPC1ALDH1A1CYP1A2CYP2C19
SCHEMBL4289075 0.81 DRD2 (0.53) NOTUMNPC1ALDH1A1CYP1A2CYP2C19
SCHEMBL7993369 0.80 DRD2 (0.54) NOTUMNPC1ALDH1A1CYP1A2CYP2C19
SCHEMBL4436739 0.78 NOTUM (0.43) NOTUMACE
SCHEMBL20505468 0.77 LMNA (0.46) NOTUMNPC1ALDH1A1
SCHEMBL30681525 0.77 NOTUM (0.48) NOTUMNPC1ALDH1A1CYP1A2CYP2C19
SCHEMBL30681248 0.75 DRD2 (0.45) NOTUMNPC1ALDH1A1CYP1A2CYP2C19

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-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 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-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF KCNN4, CACNA1A, KCNN3 NOTUM 1979/4885NPC1 4088/4885ALDH1A1 2105/4885

“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.