SCHEMBL14717207

SCHEMBL14717207

O=C(O)CC(NC(=O)c1csc(-c2ccccc2Cl)n1)C1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 4/20 0.52
CTSA P10619 4/20 0.43
HTR2C P28335 1/20 0.43
TLR7 Q9NYK1 1/20 0.43
FFAR2 O15552 1/20 0.42
PANK3 Q9H999 1/20 0.42
TYR P14679 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
HPGDS O60760 1/20 0.42
CNR1 P21554 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 1/20 0.41
APLNR P35414 1/20 0.41

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
SCHEMBL14661878 0.92 PANK3 (0.52) PIN1CTSAHTR2CTLR7PANK3
SCHEMBL14662575 0.92 PIN1 (0.48) PIN1CTSAFFAR2HPGDSTDP1
SCHEMBL14661956 0.89 TLR7 (0.48) PIN1CTSAHTR2CTLR7PANK3
SCHEMBL14662374 0.89 PIN1 (0.53) PIN1CTSATYRHPGDSAPLNR
SCHEMBL14662249 0.88 PIN1 (0.52) PIN1CTSATYRHPGDSTDP1
SCHEMBL14661926 0.88 PIN1 (0.67) PIN1TLR7HPGDSTDP1MAPT
SCHEMBL14716874 0.85 PIN1 (0.56) PIN1TLR7TYRRAB9AHPGDS
SCHEMBL14662578 0.84 PIN1 (0.46) PIN1CTSAHTR2CTLR7FFAR2
SCHEMBL14717457 0.83 PIN1 (0.55) PIN1CTSATLR7NPC1RAB9A
SCHEMBL14662703 0.81 PIN1 (0.52) PIN1CTSATLR7RAB9AHPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2736891-B1 SUBSTITUTED 3-(THIAZOLE-4-CARBONYL)- OR 3-(THIAZOLE-2-CARBONYL)- AMINOPROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2016-04-20 EP claimed
US-9174952-B2 Substituted 3-thiazoloamino-propionic acid derivatives and their use as pharmaceuticals SANOFI (FR) 2015-11-03 US claimed
US-20130053402-A1 SUBSTITUTED 3-THIAZOLOAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2013-02-28 US claimed
EP-2736891-B1 SUBSTITUTED 3-(THIAZOLE-4-CARBONYL)- OR 3-(THIAZOLE-2-CARBONYL)- AMINOPROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2016-04-20 EP disclosed
US-9174952-B2 Substituted 3-thiazoloamino-propionic acid derivatives and their use as pharmaceuticals SANOFI (FR) 2015-11-03 US disclosed
WO-2014053533-A1 USE OF SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AS PHARMACEUTICALS FOR PREVENTION/TREATMENT OF ATRIAL FIBRILLATION SANOFI (FR) 2014-04-10 WO disclosed
US-20130053402-A1 SUBSTITUTED 3-THIAZOLOAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2013-02-28 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-20130053402-A1 SUBSTITUTED 3-THIAZOLOAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS CTSF, CTSS, CTSK PIN1 2555/4885CTSA 11/4885HTR2C 4042/4885

“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.