SCHEMBL1913201

SCHEMBL1913201

CS(=O)(=O)c1ccc(S(=O)(=O)N[C@H]2CNC[C@@H](C(=O)NCC(c3ccccc3)c3ccccc3)C2)cc1

nearest known ligand 0.85

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
REN P00797 6/20 0.85
CYP3A4 P08684 2/20 0.39
TSHR P16473 2/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CA12 O43570 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
POLB P06746 2/20 0.39
DPP4 P27487 3/20 0.38
DPP7 Q9UHL4 3/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
ATM Q13315 1/20 0.38
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL1913230 0.92 REN (0.86) RENCYP3A4TSHRCYP2C9CYP2C19
SCHEMBL1913195 0.92 REN (1.00) RENCYP3A4TSHRPOLBMAPT
SCHEMBL1913193 0.92 REN (1.00) RENCYP3A4TSHRPOLBMAPT
SCHEMBL1913217 0.91 REN (0.83) RENTSHRPOLBKMT2AMAPT
SCHEMBL1913222 0.91 REN (0.83) RENCYP3A4TSHRCYP2C9CYP2C19
SCHEMBL1913200 0.90 REN (0.81) RENKMT2AMAPTLMNAMEN1
SCHEMBL1913194 0.89 REN (0.80) RENCYP3A4CYP2C19CA12MMP2
SCHEMBL1913218 0.88 REN (0.79) RENCYP3A4TSHRCYP2C9CYP2C19
SCHEMBL1913215 0.88 REN (0.79) RENCYP3A4CYP2C19POLBKMT2A
SCHEMBL4493620 0.88 REN (0.79) RENCYP3A4TSHRCYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163773-B2 Organic compounds NOVARTIS AG (CH) 2012-04-24 US disclosed
US-8163773-B2 Organic compounds NOVARTIS AG (CH) 2012-04-24 US disclosed
US-20090233920-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-09-17 US disclosed
US-20090233920-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-09-17 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-20090233920-A1 ORGANIC COMPOUNDS REN, ACE, AGTR1 REN 1/4885CYP3A4 424/4885TSHR 933/4885

“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.