SCHEMBL21881986

SCHEMBL21881986

C=CS(=O)(=O)c1ccc(/N=N/CCCC)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.41
RAB9A P51151 3/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 2/20 0.41
TSHR P16473 2/20 0.41
NPC1 O15118 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
XBP1 P17861 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
MDM2 Q00987 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KDM4E B2RXH2 1/20 0.36
CA2 P00918 6/20 0.33
CA12 O43570 4/20 0.33
CA9 Q16790 4/20 0.33
POLB P06746 2/20 0.33
CYP2D6 P10635 1/20 0.33
MEN1 O00255 2/20 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
SCHEMBL18034190 0.75 MAPT (0.50) SMN1; SMN2RAB9AMAPTLMNATSHR
SCHEMBL1373404 0.74 MAPT (0.48) SMN1; SMN2RAB9AMAPTLMNATSHR
SCHEMBL10181728 0.72 CA2 (0.61) SMN1; SMN2RAB9AMAPTLMNATSHR
SCHEMBL19844938 0.71 MAPT (0.46) SMN1; SMN2RAB9AMAPTLMNATSHR
SCHEMBL11332676 0.71 CA2 (0.62) SMN1; SMN2RAB9AMAPTLMNATSHR
SCHEMBL11340951 0.71 TSHR (0.62) SMN1; SMN2RAB9AMAPTLMNATSHR
SCHEMBL11331066 0.70 CA2 (0.60) SMN1; SMN2MAPTLMNAALDH1A1TP53
SCHEMBL11334081 0.70 CA2 (0.60) SMN1; SMN2MAPTLMNAALDH1A1TP53
SCHEMBL11326055 0.70 CA2 (0.60) SMN1; SMN2MAPTLMNAALDH1A1TP53
SCHEMBL11323074 0.70 CA2 (0.60) SMN1; SMN2MAPTLMNAALDH1A1TP53

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-11155568-B2 Bioadhesives NUTECH VENTURES (US) 2021-10-26 US disclosed
US-20200095270-A1 METHODS OF MAKING AND USING LIGNIN DERIVATIVES NUTECH VENTURES 2020-03-26 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-11155568-B2 Bioadhesives EPCAM, VCAM1, SELP SMN1; SMN2 4455/4885RAB9A 2402/4885MAPT 1598/4885
US-20200095270-A1 METHODS OF MAKING AND USING LIGNIN DERIVATIVES HLCS, LOX, DCXR SMN1; SMN2 4440/4885RAB9A 3730/4885MAPT 1550/4885

“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.