SCHEMBL8288446

SCHEMBL8288446

O=C(CS)NCc1nc2ccccc2[nH]1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
POLB P06746 2/20 0.60
RAB9A P51151 2/20 0.60
SMN1; SMN2 Q16637 3/20 0.59
TSHR P16473 2/20 0.59
MAPK10 P53779 2/20 0.59
KDM4E B2RXH2 4/20 0.56
ALDH1A1 P00352 3/20 0.56
KMT2A Q03164 1/20 0.56
MAPT P10636 2/20 0.55
PKM P14618 1/20 0.55
HTT P42858 2/20 0.55
GAA P10253 2/20 0.53
CHRM1 P11229 1/20 0.52
HSD17B10 Q99714 1/20 0.52

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
SCHEMBL1386409 0.87 LMNA (0.62) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL1386414 0.87 LMNA (0.62) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL12201106 0.85 SMN1; SMN2 (0.75) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL17309673 0.84 LMNA (0.59) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL305355 0.83 POLB (0.64) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL8278816 0.83 SMN1; SMN2 (0.60) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL12851299 0.82 HTT (0.74) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL7977173 0.82 POLB (0.63) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL3915446 0.82 POLB (0.63) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL12201101 0.82 LMNA (0.57) LMNAPOLBRAB9ASMN1; SMN2TSHR

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-20070281937-A1 Ion Channel Modulators SCION PHARMACEUTICALS, INC. 2007-12-06 US disclosed
US-20070203194-A1 Calcium channel modulators comprising 3-thio-4H-1,2,4-triazoles or S-oxides thereof; angina, hypertension, congestive heart failure, myocardial ischemia, arrhythmia, diabetes, urinary incontinence, stroke, pain, brain injury, or neuronal disorders SCION PHARMACEUTICALS, INC. (US) 2007-08-30 US disclosed
US-20070203194-A1 Calcium channel modulators comprising 3-thio-4H-1,2,4-triazoles or S-oxides thereof; angina, hypertension, congestive heart failure, myocardial ischemia, arrhythmia, diabetes, urinary incontinence, stroke, pain, brain injury, or neuronal disorders SCION PHARMACEUTICALS, INC. (US) 2007-08-30 US disclosed
WO-2005087750-A1 ION CHANNEL MODULATORS WYETH (US) 2005-09-22 WO 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-20070281937-A1 Ion Channel Modulators CACNA1B, CACNA1C, TRPV1 LMNA 1903/4885POLB 4663/4885RAB9A 1595/4885
US-20070203194-A1 Calcium channel modulators comprising 3-thio-4H-1,2,4-triazoles or S-oxides thereof; angina, hypertension, congestive heart failure, myocardial ischemia, arrhythmia, diabetes, urinary incontinence, stroke, pain, brain injury, or neuronal disorders CACNA1C, CACNA1D, CACNA1G LMNA 3778/4885POLB 4760/4885RAB9A 2889/4885

“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.