SCHEMBL3557404

SCHEMBL3557404

Cc1cc(NC(=O)NCCN2CCC(N(C)S(=O)(=O)c3c(F)cccc3F)CC2)cc(C)n1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 8/20 0.42
KMT2A Q03164 3/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 1/20 0.41
HTR2A P28223 2/20 0.41
RAB9A P51151 1/20 0.41
LMNA P02545 2/20 0.40
UTS2R Q9UKP6 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL3563156 0.91 CCR3 (0.42) CCR3KMT2ATP53MAPTMEN1
SCHEMBL3552561 0.90 KMT2A (0.42) CCR3KMT2ATP53MAPTMEN1
SCHEMBL3566882 0.90 CCR3 (0.42) CCR3KMT2ATP53MAPTMEN1
SCHEMBL3564358 0.88 HTR2A (0.55) CCR3POLBHTR2ALMNAALDH1A1
SCHEMBL3568175 0.87 L3MBTL1 (0.43) CCR3TP53MAPTPOLBHTR2A
SCHEMBL3561910 0.87 HTR2A (0.51) CCR3KMT2AMEN1HTR2ALMNA
SCHEMBL3565549 0.86 HTR2A (0.49) KMT2AMAPTMEN1POLBHTR2A
SCHEMBL3566781 0.86 DPP4 (0.41) CCR3HTR2ALMNAKDM4EALDH1A1
SCHEMBL3564913 0.86 HTR2A (0.55) CCR3TP53POLBHTR2ALMNA
SCHEMBL3565139 0.85 L3MBTL1 (0.59) POLBLMNANPSR1

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 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.