SCHEMBL14768596

SCHEMBL14768596

Cc1cc(Cl)cc(Sc2ccc(C#N)cc2CN2CCSCC2)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
DRD2 P14416 3/20 0.37
DRD4 P21917 3/20 0.37
DRD3 P35462 3/20 0.37
CYP2A13 Q16696 1/20 0.36
HTR1A P08908 1/20 0.34
HTR3A P46098 1/20 0.34
ADORA1 P30542 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GPR6 P46095 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL14768634 0.92 ADORA2A (0.35) DRD2DRD4DRD3CYP2A13ADORA1
SCHEMBL14768607 0.89 CHRNA7 (0.39) L3MBTL1DRD2DRD4DRD3HTR1A
SCHEMBL14768623 0.88 CYP2A13 (0.40) L3MBTL1DRD2DRD4DRD3CYP2A13
SCHEMBL14768591 0.87 ACHE (0.38) DRD2DRD4DRD3HTR1AHTR3A
SCHEMBL14768585 0.87 KDM1A (0.38) DRD2DRD4DRD3HTR1AHTR3A
SCHEMBL14768622 0.86 KMT2A (0.40) DRD2DRD4DRD3HTR1AHTR3A
SCHEMBL14768601 0.85 USP2 (0.34) DRD2DRD4DRD3ADORA1SMN1; SMN2
SCHEMBL14768595 0.82 MEN1 (0.35) DRD2DRD4DRD3HTR1AHTR3A
SCHEMBL14039266 0.82 MLNR (0.39) DRD2DRD4DRD3HTR1AHTR3A
SCHEMBL15334534 0.82 AR (0.35) HTR1AHTR3AALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160031841-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. 2016-02-04 US disclosed
US-9187425-B2 2,5-disubstituted arylsulfonamide CCR3 antagonists AXIKIN PHARMACEUTICALS, INC. (US) 2015-11-17 US disclosed
US-20140066446-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. (US) 2014-03-06 US disclosed
US-8563544-B2 2,5-disubstituted arylsulfonamide CCR3 antagonists AXIKIN PHARMACEUTICALS, INC. (US) 2013-10-22 US disclosed
US-20130065889-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS AXIKIN PHARMACEUTICALS, INC. (US) 2013-03-14 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 (3 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-20160031841-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS CCR3, CCR1, CCR4 L3MBTL1 2897/4885DRD2 1856/4885DRD4 2939/4885
US-20140066446-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS CCR3, CCR1, CCR4 L3MBTL1 2897/4885DRD2 1856/4885DRD4 2939/4885
US-20130065889-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS CCR3, CCR1, CCR4 L3MBTL1 2897/4885DRD2 1856/4885DRD4 2939/4885

“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.