SCHEMBL7336172

SCHEMBL7336172

CC(C)(N)CNC(=O)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
POLB P06746 1/20 0.36
HDAC6 Q9UBN7 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
PREP P48147 1/20 0.34
FAP Q12884 1/20 0.34
DPP4 P27487 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
CA4 P22748 1/20 0.31
CA9 Q16790 1/20 0.31
MAPT P10636 3/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
KDM4E B2RXH2 1/20 0.30
GRM4 Q14833 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL9497821 0.83 ALDH1A1 (0.33) ALDH1A1
SCHEMBL2392882 0.81 ALDH1A1 (0.48) CA2CA7CA14POLBHDAC6
SCHEMBL28307781 0.79 MEN1 (0.36) ALDH1A1
SCHEMBL12335918 0.79 RIPK1 (0.46) POLBL3MBTL1RAB9A
SCHEMBL9497704 0.79 CFTR (0.31)
SCHEMBL24574899 0.79 SMN1; SMN2 (0.45) CA1CA2CA7CA14POLB
SCHEMBL26629354 0.79 PREP (0.40) CA1CA2CA7CA14POLB
SCHEMBL8962237 0.79 POLB (0.38) CA1CA2CA7CA14POLB
Hydrochloric Acid SCHEMBL28308666 0.78 MEN1 (0.35) ALDH1A1
SCHEMBL2040611 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014147640-A2 PROCESS FOR THE PREPARATION OF ANAGLIPTIN GLENMARK PHARMACEUTICALS LIMITED; GLENMARK GENERICS LIMITED (IN) 2014-09-25 WO disclosed
US-20110312933-A1 OXYINDOLE DERIVATIVES WITH MOTILIN RECEPTOR AGONISTIC ACTIVITY RAQUALIA PHARMA INC. (JP) 2011-12-22 US disclosed
US-6432969-B1 NON-INSULIN DEPENDENT DIABETES, OBESITY, ARTHRITIS, AND OSTEOPOROSIS TREATMENT NOVARTIS AG (CH) 2002-08-13 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-20110312933-A1 OXYINDOLE DERIVATIVES WITH MOTILIN RECEPTOR AGONISTIC ACTIVITY GPR68, GPR88, GPR52 CA1 4570/4885CA2 2090/4885CA7 2921/4885

“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.