SCHEMBL756476

SCHEMBL756476

Cc1ccccc1Cn1ccc(NC(=O)c2ccccc2F)n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.62
LMNA P02545 4/20 0.60
KMT2A Q03164 1/20 0.60
SMN1; SMN2 Q16637 7/20 0.58
MAPT P10636 5/20 0.57
KDM4E B2RXH2 3/20 0.57
CACNA1G O43497 2/20 0.56
CACNA1H O95180 2/20 0.56
CACNA1I Q9P0X4 2/20 0.56
EGFR P00533 1/20 0.55
GAA P10253 3/20 0.55
ALDH1A1 P00352 6/20 0.54
POLB P06746 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
HSD17B10 Q99714 2/20 0.51
TP53 P04637 1/20 0.51
GLA P06280 1/20 0.51
APP P05067 1/20 0.51

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
SCHEMBL757452 0.88 STIM1 (0.61) NPSR1LMNAKMT2ASMN1; SMN2MAPT
SCHEMBL757136 0.84 STIM1 (0.62) NPSR1LMNAKMT2ASMN1; SMN2MAPT
SCHEMBL758055 0.81 SMN1; SMN2 (0.52) NPSR1LMNAKMT2ASMN1; SMN2MAPT
SCHEMBL758443 0.81 L3MBTL1 (0.55) NPSR1LMNASMN1; SMN2MAPTEGFR
SCHEMBL3439964 0.81 CACNA1G (0.64) NPSR1LMNAKMT2ASMN1; SMN2MAPT
SCHEMBL759098 0.81 NPSR1 (0.54) NPSR1LMNAKMT2ASMN1; SMN2MAPT
SCHEMBL695987 0.80 LMNA (0.56) NPSR1LMNAKMT2ASMN1; SMN2MAPT
SCHEMBL24336238 0.80 SMN1; SMN2 (0.64) NPSR1LMNAKMT2ASMN1; SMN2MAPT
SCHEMBL758378 0.79 EGFR (0.72) NPSR1LMNAKMT2ASMN1; SMN2MAPT
SCHEMBL758359 0.79 LMNA (0.66) NPSR1LMNAKMT2ASMN1; SMN2MAPT

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-8399436-B2 N-pyrazolyl carboxamides as CRAC channel inhibitors GLAXO GROUP LIMITED (GB) 2013-03-19 US claimed
US-20120053150-A1 N-PYRAZOLYL CARBOXAMIDES AS CRAC CHANNEL INIHIBITORS GLAXO GROUP LIMITED (GB) 2012-03-01 US claimed
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-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 1293/4885LMNA 857/4885KMT2A 3401/4885
US-20100273744-A1 COMPOUNDS LTC4S, HRH4, HRH2 NPSR1 1288/4885LMNA 4198/4885KMT2A 1734/4885

“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.