SCHEMBL3566882

SCHEMBL3566882

CCN(C1CCN(CCNC(=O)Nc2cc(C)nc(C)c2)CC1)S(=O)(=O)c1c(F)cccc1F

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 9/20 0.42
KMT2A Q03164 2/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
HTR2A P28223 2/20 0.40
MEN1 O00255 1/20 0.40
NAMPT P43490 2/20 0.39
RORC P51449 1/20 0.39

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
SCHEMBL3562413 0.91 KMT2A (0.42) CCR3KMT2ATP53MAPTHTR2A
SCHEMBL3557404 0.90 CCR3 (0.42) CCR3KMT2ATP53MAPTHTR2A
SCHEMBL3563156 0.90 CCR3 (0.42) CCR3KMT2ATP53MAPTHTR2A
SCHEMBL3561109 0.88 CCR3 (0.44) CCR3HTR2ANAMPTRORC
SCHEMBL3556788 0.87 NAMPT (0.44) CCR3TP53NAMPTRORC
SCHEMBL3557281 0.87 NAMPT (0.47) CCR3KMT2AHTR2AMEN1NAMPT
SCHEMBL3564763 0.87 NAMPT (0.47) CCR3KMT2ATP53MAPTHTR2A
SCHEMBL3563101 0.86 LMNA (0.41) CCR3HTR2ANAMPTRORC
SCHEMBL3562346 0.86 NAMPT (0.43) CCR3KMT2ATP53HTR2AMEN1
SCHEMBL3556658 0.85 KMT2A (0.44) CCR3KMT2ATP53MAPTHTR2A

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 6 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
US-7750161-B2 Pyridine derivatives ACTELION PHARMACEUTICALS, LTD. (CH) 2010-07-06 US disclosed
EP-1670470-B1 PYRIDINE DERIVATIVES AND USE THEREOF AS UROTENSIN II ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2009-04-08 EP disclosed
US-20070043081-A1 Novel pyridine derivatives ACTELION PHARMACEUTICALS, LTD. (CH) 2007-02-22 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-20070043081-A1 Novel pyridine derivatives P2RY4, P2RX6, P2RX4 CCR3 2602/4885KMT2A 3265/4885TP53 4821/4885

“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.