SCHEMBL3563156

SCHEMBL3563156

Cc1cc(NC(=O)NCCN2CCC(N(C3CC3)S(=O)(=O)c3c(F)cccc3F)CC2)cc(C)n1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 10/20 0.42
HTR2A P28223 3/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
UTS2R Q9UKP6 2/20 0.40
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
ADRA2A P08913 1/20 0.39
DRD2 P14416 1/20 0.39
SLC6A2 P23975 1/20 0.39
HTR2C P28335 1/20 0.39
SLC6A4 P31645 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
RAB9A P51151 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
SCHEMBL3557404 0.91 CCR3 (0.42) CCR3HTR2AKMT2AMEN1UTS2R
SCHEMBL3566882 0.90 CCR3 (0.42) CCR3HTR2AKMT2AMEN1TP53
SCHEMBL3561832 0.90 KMT2A (0.42) CCR3HTR2AKMT2AMEN1UTS2R
SCHEMBL3554219 0.88 CCR3 (0.45) CCR3HTR2AUTS2RDRD2HTR2C
SCHEMBL3564906 0.87 CCR3 (0.41) CCR3KMT2AMEN1UTS2RTP53
SCHEMBL3561058 0.87 CCR3 (0.47) CCR3HTR2AKMT2AMEN1
SCHEMBL3565154 0.86 UTS2R (0.46) CCR3HTR2AKMT2AMEN1UTS2R
SCHEMBL3558956 0.86 LMNA (0.41) CCR3HTR2AUTS2R
SCHEMBL3556333 0.86 HTR2A (0.43) CCR3HTR2AKMT2AMEN1UTS2R
SCHEMBL3558382 0.85 MEN1 (0.45) CCR3HTR2AKMT2AMEN1UTS2R

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 2602/4885HTR2A 119/4885KMT2A 3265/4885

“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.