SCHEMBL3565680

SCHEMBL3565680

CCN(C1CCN(CCNC(=O)Nc2cc(C)nc(C)c2)CC1)S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.48
NAMPT P43490 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
MAPT P10636 5/20 0.46
TP53 P04637 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
SLC6A9 P48067 1/20 0.42
LMNA P02545 2/20 0.42
ALOX15 P16050 1/20 0.42
MAPK1 P28482 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
SCHEMBL3561750 0.93 NAMPT (0.49) NAMPTCA1CA2TP53SMN1; SMN2
SCHEMBL3557217 0.91 NAMPT (0.44) CNR1NAMPTCA1CA2MAPT
SCHEMBL3564148 0.91 NAMPT (0.49) NAMPTCA1CA2MAPTTP53
SCHEMBL3557281 0.91 NAMPT (0.47) NAMPTCA1CA2LMNAALOX15
SCHEMBL3564763 0.91 NAMPT (0.47) NAMPTCA1CA2MAPTTP53
SCHEMBL3561218 0.91 MAPT (0.45) CNR1NAMPTMAPTTP53LMNA
SCHEMBL3564369 0.90 CNR1 (0.48) CNR1CA1CA2MAPTTP53
SCHEMBL3554924 0.90 L3MBTL1 (0.51) CNR1NAMPTCA1CA2MAPT
SCHEMBL3562290 0.90 CA1 (0.49) NAMPTCA1CA2MAPTSMN1; SMN2
SCHEMBL3560963 0.90 NAMPT (0.46) NAMPTMAPTTP53SMN1; SMN2LMNA

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-7750161-B2 Pyridine derivatives ACTELION PHARMACEUTICALS, LTD. (CH) 2010-07-06 US claimed
EP-1670470-B1 PYRIDINE DERIVATIVES AND USE THEREOF AS UROTENSIN II ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2009-04-08 EP claimed
US-20070043081-A1 Novel pyridine derivatives ACTELION PHARMACEUTICALS, LTD. (CH) 2007-02-22 US claimed
EP-1670470-B1 PYRIDINE DERIVATIVES AND USE THEREOF AS UROTENSIN II ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2009-04-08 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 (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-20070043081-A1 Novel pyridine derivatives P2RY4, P2RX6, P2RX4 CNR1 16/4885NAMPT 245/4885CA1 3602/4885

“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.