SCHEMBL1448293

SCHEMBL1448293

CC(C)NC(=O)Nc1cc[c]cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.56
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA9 Q16790 3/20 0.56
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
HSD17B10 Q99714 2/20 0.47
GAA P10253 1/20 0.46
GHSR Q92847 1/20 0.44
EPHX2 P34913 2/20 0.44
RAB9A P51151 1/20 0.44
FPR2 P25090 4/20 0.42
MAPK1 P28482 1/20 0.41
FPR1 P21462 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 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
SCHEMBL13449739 0.86 CA12 (0.70) CA12CA1CA2CA9MEN1
Benzene SCHEMBL11580862 0.80 HSD17B10 (0.70) CA12CA1CA2CA9MEN1
SCHEMBL2625563 0.80 HSD17B10 (0.70) CA12CA1CA2CA9MEN1
SCHEMBL24894114 0.78 CA12 (0.62) CA12CA1CA2CA9MEN1
SCHEMBL13466499 0.78 CA12 (0.62) CA12CA1CA2CA9MEN1
SCHEMBL5851828 0.78 CA12 (0.62) CA12CA1CA2CA9MEN1
SCHEMBL19171353 0.78 MEN1 (0.64) CA12CA1CA2CA9MEN1
SCHEMBL17149422 0.78 SMN1; SMN2 (0.62) CA12CA1CA2CA9MEN1
SCHEMBL745458 0.78 ALDH1A1 (0.59) MEN1KMT2ASMN1; SMN2POLBEPHX2
SCHEMBL2632915 0.77 MDM2 (0.67) CA12CA1CA2CA9MEN1

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
WO-2011030139-A1 4- (PYRIMIDIN-2-YL) -PIPERAZINE AND 4- (PYRIMIDIN-2-YL) -PIPERIDINE DERIVATIVES AS GPR119 MODULATORS ASTRAZENECA AB (SE) 2011-03-17 WO disclosed
US-20110065706-A1 Therapeutic Agents 812 ASTRAZENECA AB (SE) 2011-03-17 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-20110065706-A1 Therapeutic Agents 812 GPR119, GPR84, GPR132 CA12 1811/4885CA1 3692/4885CA2 605/4885

“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.