SCHEMBL14768587

SCHEMBL14768587

Cc1cc(C)cc(Sc2ccc([N+](=O)[O-])cc2CN2CCSCC2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
KDM4E B2RXH2 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.43
MAPT P10636 2/20 0.43
CTSB P07858 1/20 0.42
MAPK1 P28482 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
FAAH O00519 1/20 0.42
MGLL Q99685 1/20 0.42
ALDH1A1 P00352 2/20 0.41
ACHE P22303 2/20 0.40
CACNB4 O00305 1/20 0.38
CACNA1A O00555 1/20 0.38
CACNA1G O43497 1/20 0.38
CACNG3 O60359 1/20 0.38
CACNA1F O60840 1/20 0.38
CACNA1H O95180 1/20 0.38
CACNB3 P54284 1/20 0.38
CACNA2D1 P54289 1/20 0.38

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
SCHEMBL14768636 0.93 LMNA (0.59) LMNASMN1; SMN2KDM4EL3MBTL1MAPT
SCHEMBL15334537 0.81 FAAH (0.44) LMNASMN1; SMN2KDM4EL3MBTL1MAPT
SCHEMBL14768656 0.79 LMNA (0.43) LMNASMN1; SMN2KDM4EL3MBTL1MAPT
SCHEMBL13108359 0.79 L3MBTL1 (0.51) LMNASMN1; SMN2L3MBTL1MAPTNPSR1
SCHEMBL14768634 0.77 ADORA2A (0.35)
SCHEMBL14768660 0.74 LMNA (1.00) LMNASMN1; SMN2KDM4EMAPTCTSB
SCHEMBL15334543 0.74 LMNA (0.41) LMNASMN1; SMN2KDM4EL3MBTL1MAPT
SCHEMBL19720320 0.73 ALDH1A1 (0.47) LMNASMN1; SMN2L3MBTL1MAPTNPSR1
SCHEMBL14768596 0.71 L3MBTL1 (0.38) LMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL14768601 0.69 USP2 (0.34) SMN1; SMN2ACHE

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 LMNA 4120/4885SMN1; SMN2 603/4885KDM4E 2880/4885
US-20140066446-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS CCR3, CCR1, CCR4 LMNA 4120/4885SMN1; SMN2 603/4885KDM4E 2880/4885
US-20130065889-A1 2,5-DISUBSTITUTED ARYLSULFONAMIDE CCR3 ANTAGONISTS CCR3, CCR1, CCR4 LMNA 4120/4885SMN1; SMN2 603/4885KDM4E 2880/4885

“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.