SCHEMBL3554990

SCHEMBL3554990

Cc1csc(N2CC[S+]([O-])CC2)n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 1/20 0.41
OGA O60502 2/20 0.40
MEN1 O00255 1/20 0.40
HRH3 Q9Y5N1 2/20 0.40
DPP4 P27487 1/20 0.39
POLB P06746 2/20 0.38
AR P10275 4/20 0.36
ALDH1A1 P00352 2/20 0.36
RAB9A P51151 1/20 0.36
NOS1 P29475 1/20 0.34
TP53 P04637 1/20 0.34
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
EP300 Q09472 1/20 0.34
KAT2A Q92830 1/20 0.34
KAT2B Q92831 1/20 0.34

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
SCHEMBL3511935 0.80 L3MBTL1 (0.54) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL4472290 0.80 L3MBTL1 (0.54) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL4469579 0.78 SMN1; SMN2 (0.53) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL1713003 0.77 L3MBTL1 (0.47) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL9794819 0.77 L3MBTL1 (0.47) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL6929063 0.77 ALDH1A1 (0.54) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL2228747 0.75 BAZ2A (0.49) L3MBTL1SMN1; SMN2LMNAOGAMEN1
SCHEMBL4463690 0.75 LMNA (0.68) SMN1; SMN2LMNAMEN1ARALDH1A1
SCHEMBL2080793 0.74 OGA (0.44) SMN1; SMN2OGAALDH1A1
SCHEMBL23155993 0.74 L3MBTL1 (0.57) L3MBTL1SMN1; SMN2LMNAOGAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163746-B2 Azolecarboxamide derivative ASTELLAS PHARMA INC. (JP) 2012-04-24 US disclosed
US-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-19 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-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE GPR17, NTRK1, TRPV1 L3MBTL1 3267/4885SMN1; SMN2 3601/4885LMNA 4712/4885

“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.