SCHEMBL6512359

SCHEMBL6512359

NC(=S)N1CCCC1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 9/20 0.50
REN P00797 1/20 0.47
LMNA P02545 1/20 0.47
CYP2C19 P33261 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL2194754 1.00 ACE (0.50) ACERENLMNACYP2C19HSD17B10
Hydrochloric Acid SCHEMBL3188591 0.98 ACE (0.49) ACERENLMNACYP2C19HSD17B10
SCHEMBL163319 0.83 LMNA (0.54) ACERENLMNACYP2C19HSD17B10
SCHEMBL1442233 0.83 LMNA (0.54) ACERENLMNACYP2C19HSD17B10
SCHEMBL30305374 0.83 LMNA (0.54) ACERENLMNACYP2C19HSD17B10
SCHEMBL2927893 0.83 LMNA (0.54) ACERENLMNACYP2C19HSD17B10
Hydrochloric Acid SCHEMBL951618 0.82 LMNA (0.53) ACERENLMNACYP2C19HSD17B10
SCHEMBL2679460 0.80 ACE (0.50) ACERENLMNACYP2C19HSD17B10
SCHEMBL212486 0.80 ACE (0.50) ACERENLMNACYP2C19HSD17B10
SCHEMBL9389379 0.80 ACE (0.50) ACERENLMNACYP2C19HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9169295-B2 Macrocycles and macrocycle stabilized peptides BRISTOL-MYERS SQUIBB COMPANY (US) 2015-10-27 US disclosed
EP-2627662-B1 METHODS FOR PREPARING MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES BRISTOL MYERS SQUIBB CO (US) 2015-09-16 EP disclosed
US-20130281657-A1 MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES BRISTOL-MYERS SQUIBB COMPANY (US) 2013-10-24 US disclosed
EP-2627662-A1 METHODS FOR PREPARING MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES Bristol-Myers Squibb Company (US) 2013-08-21 EP disclosed
WO-2012051405-A1 METHODS FOR PREPARING MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-19 WO disclosed
WO-2005097783-A1 THIOCARBAMOYLPROLINES MERCK PATENT GMBH (DE) 2005-10-20 WO disclosed
EP-1001762-A4 METHOD OF USING NEUROTROPHIC CARBAMATES AND UREAS GUILFORD PHARM INC (US) 2002-05-08 EP disclosed
EP-1001762-A1 METHOD OF USING NEUROTROPHIC CARBAMATES AND UREAS GPI NIL Holdings, Inc. (US) 2000-05-24 EP disclosed
WO-1998037882-A1 METHOD OF USING NEUROTROPHIC CARBAMATES AND UREAS GUILFORD PHARMACEUTICALS INC. (US) 1998-09-03 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-20130281657-A1 MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES PTMS, VIP, MTPN ACE 1283/4885REN 1517/4885LMNA 1956/4885

“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.