SCHEMBL1364147

SCHEMBL1364147

CCCCN1C(=O)NC(=O)C1(C)S

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 3/20 0.33
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 3/20 0.32
ABL1 P00519 2/20 0.32
RIN1 Q13671 2/20 0.32
RGS4 P49798 2/20 0.32
RGS8 P57771 1/20 0.32
HPGD P15428 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PDE4A P27815 5/20 0.30
ADORA2A P29274 5/20 0.30
PDE4B Q07343 5/20 0.30
PDE4C Q08493 5/20 0.30
PDE4D Q08499 5/20 0.30
CNR1 P21554 2/20 0.30
ADORA3 P0DMS8 1/20 0.30
ADORA2B P29275 1/20 0.30

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
SCHEMBL1364141 0.88 SMN1; SMN2 (0.32) SMN1; SMN2L3MBTL1
SCHEMBL1362015 0.79 AKR1B1 (0.33)
SCHEMBL1362827 0.78 SMN1; SMN2 (0.38) SMN1; SMN2GAATP53TDP1ABL1
SCHEMBL1363355 0.72 GAA (0.36) GAATP53TDP1ABL1RIN1
SCHEMBL11535351 0.72 MGLL (0.36) SMN1; SMN2GAATP53HPGDCNR1
SCHEMBL1364225 0.71 PIK3CD (0.34) KMT2A
SCHEMBL4621192 0.71 PIK3CD (0.34) KMT2A
SCHEMBL4620897 0.69 SMN1; SMN2 (0.35) SMN1; SMN2RGS4RGS8
SCHEMBL11681731 0.69 GAA (0.34) SMN1; SMN2GAATP53TDP1ABL1
SCHEMBL1363415 0.69 TP53 (0.34) SMN1; SMN2GAATP53MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8066977-B2 Agent for permanent hair waving containing heterocyclic mercapto compound SHOWA DENKO K.K. (JP) 2011-11-29 US disclosed
EP-1883454-B1 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND SHOWA DENKO KK (JP) 2009-11-04 EP disclosed
US-20090208439-A1 Agent for Permanent Hair Waving Containing Heterocyclic Mercapto Compound SHOWA DENKO K.K. (JP) 2009-08-20 US disclosed
EP-1883454-A2 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND Showa Denko K.K. (JP) 2008-02-06 EP disclosed
WO-2006126729-A2 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND SHOWA DENKO K.K. (JP) 2006-11-30 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 (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-20090208439-A1 Agent for Permanent Hair Waving Containing Heterocyclic Mercapto Compound NSD3, WNT3, MSRB3 SMN1; SMN2 3473/4885GAA 4854/4885TP53 2453/4885

“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.