SCHEMBL1361379

SCHEMBL1361379

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

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.47
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 1/20 0.36
KDM4E B2RXH2 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
PADI4 Q9UM07 1/20 0.35
ALDH1A1 P00352 1/20 0.35
FAAH O00519 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL1362195 0.89 POLB (0.38) CNR1RAB9APOLBPADI4ALDH1A1
SCHEMBL1364096 0.82 POLB (0.41) CNR1POLBPADI4ALDH1A1
SCHEMBL22661311 0.79 CNR1 (0.51) CNR1RAB9ASMN1; SMN2ALDH1A1FAAH
SCHEMBL1362107 0.79 CNR1 (0.49) CNR1RAB9ASMN1; SMN2POLBKDM4E
SCHEMBL5584328 0.78 POLB (0.61) CNR1RAB9ASMN1; SMN2POLBPADI4
SCHEMBL11471446 0.75 CNR1 (0.49) CNR1RAB9ASMN1; SMN2POLBKDM4E
SCHEMBL1364230 0.74 ALDH1A1 (0.42) CNR1SMN1; SMN2POLBALDH1A1MAPK1
SCHEMBL1362594 0.74 TSHR (0.37) POLBCYP2C19PADI4
SCHEMBL14359543 0.72 FPR2 (0.41) CNR1RAB9ASMN1; SMN2POLBKDM4E
SCHEMBL5584087 0.71 POLB (0.57) CNR1RAB9ASMN1; SMN2POLBPADI4

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 CNR1 520/4885RAB9A 4419/4885SMN1; SMN2 3473/4885

“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.