SCHEMBL10134975

SCHEMBL10134975

N#Cc1ccc2c(c1)nc(N1CCC(c3cccnc3)C1)c1ccsc12

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.41
GBA1 P04062 1/20 0.39
CYP11B2 P19099 2/20 0.38
CSNK2A1 P68400 4/20 0.38
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37
SCN9A Q15858 1/20 0.36
CYP11B1 P15538 1/20 0.36
GPR6 P46095 4/20 0.34
VCP P55072 1/20 0.33
NAMPT P43490 1/20 0.33
USP30 Q70CQ3 1/20 0.33
CYP3A4 P08684 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
SCHEMBL11932265 0.86 PDE10A (0.43) PDE10AGBA1CYP11B2CSNK2A1SCN9A
SCHEMBL10134996 0.80 PRKCI (0.46) CSNK2A1
SCHEMBL10134906 0.78 EGLN2 (0.42) CSNK2A1
SCHEMBL10134963 0.75 HRH3 (0.45) CSNK2A1
SCHEMBL10134961 0.75 HRH4 (0.40) CSNK2A1CYP3A4
SCHEMBL10134989 0.74 HRH4 (0.55) CSNK2A1CYP3A4
SCHEMBL10134999 0.74 HTR2C (0.48) CSNK2A1DRD2DRD3CYP3A4
SCHEMBL10134981 0.74 SMPD3 (0.47) CSNK2A1
SCHEMBL10134945 0.73 IRAK4 (0.43) CSNK2A1DRD3SCN9A
SCHEMBL10134976 0.72 ALDH1A1 (0.47) CSNK2A1NAMPTCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120208792-A1 PROTEIN KINASE MODULATORS CYLENE PHARMACEUTICALS, INC. (US) 2012-08-16 US disclosed
US-20120208792-A1 PROTEIN KINASE MODULATORS CYLENE PHARMACEUTICALS, INC. (US) 2012-08-16 US disclosed
US-8168651-B2 Protein kinase modulators CYLENE PHARMACEUTICALS, INC. (US) 2012-05-01 US disclosed
US-8168651-B2 Protein kinase modulators CYLENE PHARMACEUTICALS, INC. (US) 2012-05-01 US disclosed
US-20090239859-A1 PROTEIN KINASE MODULATORS SENHWA BIOSCIENCES, INC. (TW) 2009-09-24 US disclosed
US-20090239859-A1 PROTEIN KINASE MODULATORS SENHWA BIOSCIENCES, INC. (TW) 2009-09-24 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-20120208792-A1 PROTEIN KINASE MODULATORS PIM1, PIM2, PIM3 PDE10A 1921/4885GBA1 3864/4885CYP11B2 4003/4885
US-20090239859-A1 PROTEIN KINASE MODULATORS PIM1, PIM2, PIM3 PDE10A 1921/4885GBA1 3864/4885CYP11B2 4003/4885

“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.