SCHEMBL10185293

SCHEMBL10185293

CCCCCN1C(=O)COc2ccc(NC3CC3)cc21

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.47
CHRM1 P11229 4/20 0.46
TP53 P04637 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PRKCQ Q04759 2/20 0.45
CHRM5 P08912 1/20 0.45
CHRM3 P20309 1/20 0.45
TSHR P16473 1/20 0.45
CYP3A4 P08684 2/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
THRB P10828 1/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL89019 0.88 TSHR (0.56) POLBCHRM1TP53MEN1KMT2A
SCHEMBL89564 0.87 TSHR (0.57) POLBCHRM1TP53MEN1KMT2A
SCHEMBL8265645 0.84 POLB (0.46) POLBCHRM1MEN1KMT2APRKCQ
SCHEMBL89692 0.84 TSHR (0.54) POLBTP53MEN1KMT2APRKCQ
SCHEMBL10184668 0.84 POLB (0.52) POLBTP53MEN1KMT2ATSHR
SCHEMBL8265361 0.81 SCD (0.50) POLBCHRM1TP53MEN1KMT2A
SCHEMBL90317 0.80 ALDH1A1 (0.44) POLBMEN1KMT2ATSHR
SCHEMBL8235590 0.80 ALDH1A1 (0.44) POLBMEN1KMT2ATSHR
SCHEMBL10181988 0.79 TSHR (0.62) POLBTP53MEN1KMT2ATSHR
SCHEMBL8266103 0.79 PRKCQ (0.47) POLBMEN1KMT2APRKCQTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178559-B2 Organic compounds NOVARTIS AG (CH) 2012-05-15 US disclosed
US-8178559-B2 Organic compounds NOVARTIS AG (CH) 2012-05-15 US disclosed
US-8084450-B2 Organic compounds NOVARTIS AG (CH) 2011-12-27 US disclosed
US-8084450-B2 Organic compounds NOVARTIS AG (CH) 2011-12-27 US disclosed
US-20110263560-A1 Organic Compounds NOVARTIS AG (CH) 2011-10-27 US disclosed
US-20110263560-A1 Organic Compounds NOVARTIS AG (CH) 2011-10-27 US disclosed
EP-2177518-A1 Organic compounds Novartis AG (CH) 2010-04-21 EP disclosed
US-20090312304-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-12-17 US disclosed
US-20090312304-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-12-17 US disclosed
EP-1833816-B1 SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS NOVARTIS AG (CH) 2009-11-11 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 (2 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-20110263560-A1 Organic Compounds REN, ACE, OTC POLB 663/4885CHRM1 1634/4885TP53 3015/4885
US-20090312304-A1 ORGANIC COMPOUNDS REN, ACE, PIGO POLB 277/4885CHRM1 1948/4885TP53 4089/4885

“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.