SCHEMBL4995972

SCHEMBL4995972

CC1CC(C)CN(C(=O)[C@@H]2Cc3ccccc3N2C(=O)O)C1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.47
TP53 P04637 2/20 0.46
PLA2G1B P04054 1/20 0.44
ATG4B Q9Y4P1 1/20 0.44
ACE P12821 2/20 0.43

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
SCHEMBL4999585 1.00 NOTUM (0.47) NOTUMTP53PLA2G1BATG4BACE
SCHEMBL5005143 1.00 NOTUM (0.47) NOTUMTP53PLA2G1BATG4BACE
SCHEMBL5005144 1.00 NOTUM (0.47) NOTUMTP53PLA2G1BATG4BACE
SCHEMBL4999589 1.00 NOTUM (0.47) NOTUMTP53PLA2G1BATG4BACE
SCHEMBL4995964 1.00 NOTUM (0.47) NOTUMTP53PLA2G1BATG4BACE
SCHEMBL4993635 0.85 SMN1; SMN2 (0.51) TP53
SCHEMBL4996353 0.85 SMN1; SMN2 (0.51) TP53
SCHEMBL5005183 0.85 SMN1; SMN2 (0.51) TP53
SCHEMBL4996339 0.85 SMN1; SMN2 (0.51) TP53
SCHEMBL5002871 0.85 SMN1; SMN2 (0.51) TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080221114-A1 2-(Cyclic Aminocarbonyl) Indoline Derivative and Medicinal Composition Containing the Same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-09-11 US disclosed
EP-1840126-A1 2-(CYCLIC AMINOCARBONYL)INDOLINE DERIVATIVE AND MEDICINAL COMPOSITION CONTAINING THE SAME Dainippon Sumitomo Pharma Co., Ltd. (JP) 2007-10-03 EP 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-20080221114-A1 2-(Cyclic Aminocarbonyl) Indoline Derivative and Medicinal Composition Containing the Same CYP11B2, CYP11B1, GRIN2A NOTUM 4046/4885TP53 2959/4885PLA2G1B 3894/4885

“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.