SCHEMBL756218

SCHEMBL756218

Cc1ccccc1C(=O)Nc1ccn(Cc2ccccc2Oc2ccccc2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.52
CACNA1G O43497 3/20 0.51
CACNA1H O95180 3/20 0.51
CACNA1I Q9P0X4 3/20 0.51
LMNA P02545 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 3/20 0.48
KDM4E B2RXH2 1/20 0.48
GAA P10253 2/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
ALDH1A1 P00352 3/20 0.46
POLB P06746 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
STAT3 P40763 1/20 0.44
PTGER1 P34995 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.43

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
SCHEMBL757810 0.89 NPSR1 (0.51) NPSR1CACNA1GCACNA1HCACNA1ILMNA
SCHEMBL758443 0.88 L3MBTL1 (0.55) NPSR1LMNASMN1; SMN2MAPTGAA
SCHEMBL756374 0.88 LMNA (0.52) NPSR1CACNA1GCACNA1HCACNA1ILMNA
SCHEMBL17318575 0.85 SMN1; SMN2 (0.50) NPSR1LMNASMN1; SMN2MAPTGAA
SCHEMBL758049 0.84 NPSR1 (0.52) NPSR1CACNA1GCACNA1HCACNA1ILMNA
SCHEMBL761251 0.81 KDM4C (0.49) NPSR1CACNA1GCACNA1HCACNA1ILMNA
SCHEMBL756929 0.81 SMN1; SMN2 (0.52) NPSR1CACNA1GCACNA1HCACNA1ILMNA
SCHEMBL757442 0.81 STIM1 (0.56) NPSR1LMNASMN1; SMN2KMT2AMAPT
SCHEMBL757152 0.81 STIM1 (0.52) NPSR1CACNA1GCACNA1HCACNA1ILMNA
SCHEMBL758440 0.80 SMN1; SMN2 (0.49) NPSR1CACNA1GCACNA1HCACNA1ILMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8399436-B2 N-pyrazolyl carboxamides as CRAC channel inhibitors GLAXO GROUP LIMITED (GB) 2013-03-19 US disclosed
US-8399436-B2 N-pyrazolyl carboxamides as CRAC channel inhibitors GLAXO GROUP LIMITED (GB) 2013-03-19 US disclosed
US-8399436-B2 N-pyrazolyl carboxamides as CRAC channel inhibitors GLAXO GROUP LIMITED (GB) 2013-03-19 US disclosed
US-20120053150-A1 N-PYRAZOLYL CARBOXAMIDES AS CRAC CHANNEL INIHIBITORS GLAXO GROUP LIMITED (GB) 2012-03-01 US disclosed
US-20120053150-A1 N-PYRAZOLYL CARBOXAMIDES AS CRAC CHANNEL INIHIBITORS GLAXO GROUP LIMITED (GB) 2012-03-01 US disclosed
US-20120053150-A1 N-PYRAZOLYL CARBOXAMIDES AS CRAC CHANNEL INIHIBITORS GLAXO GROUP LIMITED (GB) 2012-03-01 US disclosed
WO-2010122089-A1 N-PYRAZOLYL CARBOXAMIDES AS CRAC CHANNEL INHIBITORS GLAXO GROUP LIMITED (GB) 2010-10-28 WO disclosed
US-20100273744-A1 COMPOUNDS GORE PAUL MARTIN 2010-10-28 US disclosed
US-20100273744-A1 COMPOUNDS GORE PAUL MARTIN 2010-10-28 US disclosed
US-20100273744-A1 COMPOUNDS GORE PAUL MARTIN 2010-10-28 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 (2 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-20120053150-A1 N-PYRAZOLYL CARBOXAMIDES AS CRAC CHANNEL INIHIBITORS ORAI1, TRPV1, CACNA1E NPSR1 1293/4885CACNA1G 20/4885CACNA1H 19/4885
US-20100273744-A1 COMPOUNDS LTC4S, HRH4, HRH2 NPSR1 1288/4885CACNA1G 4743/4885CACNA1H 4840/4885

“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.