SCHEMBL3562875

SCHEMBL3562875

Cc1cc(NC(=O)NCCN2CCC(N(C3CC3)S(=O)(=O)c3cccc(Cl)c3)CC2)cc(C)n1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.46
KMT2A Q03164 2/20 0.46
PKM P14618 1/20 0.45
LMNA P02545 1/20 0.44
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
TP53 P04637 4/20 0.42
CNR1 P21554 3/20 0.42
UTS2R Q9UKP6 1/20 0.41
CCR3 P51677 1/20 0.40
MEN1 O00255 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL3564316 0.92 HTR2A (0.55) MAPTKMT2APKMLMNAHTR2A
SCHEMBL3556333 0.91 HTR2A (0.43) MAPTKMT2AHTR2AHTR2CTP53
SCHEMBL3561218 0.91 MAPT (0.45) MAPTKMT2APKMLMNAHTR2A
SCHEMBL3564369 0.91 CNR1 (0.48) MAPTLMNATP53CNR1CA1
SCHEMBL3565154 0.90 UTS2R (0.46) MAPTKMT2AHTR2AHTR2CTP53
SCHEMBL3554219 0.90 CCR3 (0.45) LMNAHTR2AHTR2CUTS2RCCR3
SCHEMBL3556001 0.89 HTR7 (0.41) MAPTTP53CNR1UTS2RCA1
SCHEMBL3562563 0.88 CACNA1B (0.52) CCR3
SCHEMBL3558961 0.88 HTR2A (0.46) KMT2ALMNAHTR2ATP53CCR3
SCHEMBL3564906 0.87 CCR3 (0.41) KMT2ATP53CNR1UTS2RCCR3

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 MAPT 1151/4885KMT2A 3265/4885PKM 492/4885

“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.