SCHEMBL890350

SCHEMBL890350

CSCCOc1ccc(N=Nc2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.60
CHRNA10 Q9GZZ6 1/20 0.60
CHRNA9 Q9UGM1 1/20 0.60
PPARA Q07869 7/20 0.52
PPARG P37231 4/20 0.47
PPARD Q03181 3/20 0.47
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
MAPK1 P28482 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KCNA3 P22001 1/20 0.41
LTA4H P09960 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LSS P48449 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL11285757 0.83 KCNA3 (0.58) CHRNA7NPC1RAB9AALDH1A1KCNA3
SCHEMBL11693379 0.80 CHRNA7 (0.66) CHRNA7CHRNA10CHRNA9PPARAPPARG
SCHEMBL28330356 0.80 CHRNA7 (0.66) CHRNA7CHRNA10CHRNA9PPARAPPARG
SCHEMBL9224163 0.77 ALDH1A1 (0.67) CHRNA7CHRNA10CHRNA9PPARAPPARG
SCHEMBL29183506 0.77 TAAR1 (0.67) CHRNA7CHRNA10CHRNA9PPARAPPARG
SCHEMBL9224161 0.77 ALDH1A1 (0.67) CHRNA7CHRNA10CHRNA9PPARAPPARG
SCHEMBL11836150 0.76 LTA4H (0.64) CHRNA7CHRNA10CHRNA9PPARANPC1
SCHEMBL19281444 0.76 LTA4H (0.64) CHRNA7CHRNA10CHRNA9PPARANPC1
SCHEMBL4942746 0.76 LTA4H (0.64) CHRNA7CHRNA10CHRNA9PPARANPC1
SCHEMBL1984435 0.76 LTA4H (0.64) CHRNA7CHRNA10CHRNA9PPARANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110275070-A1 HYBRIDIZATION AND MISMATCH DISCRIMINATION USING OLIGONUCLEOTIDES CONJUGATED TO MINOR GROOVE BINDERS EPOCH PHARMACEUTICALS, INC. 2011-11-10 US disclosed
US-7794945-B2 Hybridization and mismatch discrimination using oligonucleotides conjugated to minor groove binders ELITECH HOLDING B.V. (NL) 2010-09-14 US disclosed
US-7556923-B1 Hybridization and mismatch discrimination using oligonucleotides conjugated to minor groove binders EPOCH BIOSCIENCES, INC. (US) 2009-07-07 US disclosed
US-20090048427-A1 HYBRIDIZATION AND MISMATCH DISCRIMINATION USING OLIGONUCLEOTIDES CONJUGATED TO MINOR GROOVE BINDERS EPOCH BIOSCIENCES, INC. (US) 2009-02-19 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-20090048427-A1 HYBRIDIZATION AND MISMATCH DISCRIMINATION USING OLIGONUCLEOTIDES CONJUGATED TO MINOR GROOVE BINDERS DDB1, LIG3, MSH2 CHRNA7 396/4885CHRNA10 1004/4885CHRNA9 1321/4885

“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.