SCHEMBL1752274

SCHEMBL1752274

CCC(=O)NCc1ccc(Cl)c(C(C)(C)O[SiH2]C(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
P2RX7 Q99572 6/20 0.41
HPGD P15428 1/20 0.38
PTGES O14684 2/20 0.37
TRPV1 Q8NER1 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
SCHEMBL1750280 0.88 TSHR (0.58) TSHRSMN1; SMN2P2RX7HPGD
SCHEMBL1751533 0.88 TSHR (0.45) TSHRSMN1; SMN2P2RX7HPGD
SCHEMBL1751254 0.87 P2RX7 (0.44) TSHRSMN1; SMN2P2RX7HPGDTRPV1
SCHEMBL1751211 0.85 EPHX2 (0.48) TSHRSMN1; SMN2P2RX7HPGD
SCHEMBL3092964 0.81 HTR1A (0.43) TSHRSMN1; SMN2
SCHEMBL3093509 0.81 HTR7 (0.41) TSHRSMN1; SMN2P2RX7
SCHEMBL3089010 0.79 TSHR (0.43) TSHRSMN1; SMN2TRPV1
SCHEMBL1750509 0.79 KDM4E (0.46) SMN1; SMN2HPGDTRPV1
SCHEMBL3074352 0.77 TRPV1 (0.40) TRPV1
SCHEMBL3088565 0.76 PRMT5 (0.47) P2RX7

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-7968720-B2 Secondary amines as renin inhibitors ACTELION PHARMACEUTICALS LTD. (CH) 2011-06-28 US disclosed
US-20090176823-A1 Secondary Amines as Renin Inhibitors ACTELION PHARMACEUTICALS LTD. (CH) 2009-07-09 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-20090176823-A1 Secondary Amines as Renin Inhibitors REN, ACE, AGTR1 TSHR 1994/4885SMN1; SMN2 4441/4885P2RX7 1294/4885

“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.