SCHEMBL417131

SCHEMBL417131

O=C(NC1CCNCC1)c1cscn1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 9/20 0.55
UTS2R Q9UKP6 1/20 0.53
MCHR1 Q99705 1/20 0.50
ACKR3 P25106 1/20 0.45
EPHX1 P07099 2/20 0.44
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.41
HPGDS O60760 1/20 0.39

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
SCHEMBL31737693 0.91 UTS2R (0.46) SMYD3UTS2RMCHR1ACKR3KDM4E
SCHEMBL4970792 0.89 MCHR1 (0.55) SMYD3UTS2RMCHR1KDM4E
SCHEMBL28264042 0.84 RAB9A (0.52) MCHR1
SCHEMBL2554945 0.84 RAB9A (0.52) MCHR1
SCHEMBL27124836 0.82 MCHR1 (0.50) UTS2RMCHR1KDM4E
SCHEMBL29745057 0.76 GRM5 (0.67) SMYD3UTS2RKDM4E
Hydrochloric Acid SCHEMBL28155973 0.75 GRM5 (0.65) SMYD3UTS2RKDM4E
Hydrochloric Acid SCHEMBL4713340 0.75 GRM5 (0.65) SMYD3UTS2RKDM4E
SCHEMBL17396263 0.74 SMYD3 (0.52) SMYD3ACKR3EPHX1POLBHPGDS
SCHEMBL28184168 0.73 KDM4E (0.42) UTS2RKDM4E

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025242565-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF IN THE PREVENTION OR THERAPY OF DISEASES Samsara Therapeutics Inc. (US) 2025-11-27 WO disclosed
CN-105744833-B Use the fluidized bed prilling of Prohexadione calcium and the aqueous solution of mineral sulfates 巴斯夫欧洲公司 2018-07-24 CN disclosed
CN-103561570-B Alkoxylated polyalkyleneimine as agrochemical formula dispersant 巴斯夫欧洲公司 2016-10-05 CN disclosed
CN-104378980-B Comprise the emulsifiable concentrate of pesticide, amide, carbonic ester and hydrocarbon 巴斯夫欧洲公司 2016-08-24 CN disclosed
US-8106048-B2 protozoal infestations in humans and animals, by bacteria, viruses or proteinaceous agents; neurological diseases or disorders; ischemia and/or reperfusion injury; 4-(4-Ethoxycarbonyl-4,5-dihydro-thiazol-2-yl)-piperidine-1-carboxylic acid t-butyl ester 4SC AG (DE) 2012-01-31 US disclosed
US-20120022068-A1 NOVEL HETEROCYCLIC NF-kB INHIBITORS 4SC AG (DE) 2012-01-26 US disclosed
EP-2343293-A1 NOVEL PIPERIDIN-4-YL-THIAZOLE-CARBOXAMIDE ANALOGUES AS INHIBITORS OF T-CELL PROLIFERATION AND USES THEREOF 4SC AG (DE) 2011-07-13 EP disclosed
US-20110052532-A1 Pharmaceutical composition comprising a cytokine STROBL STEFAN 2011-03-03 US disclosed
US-20100267717-A1 Novel Heterocyclic NF-kB Inhibitors 4SC AG (DE) 2010-10-21 US disclosed
US-7812041-B2 Heterocyclic NF-κB inhibitors 4SC AG (DE) 2010-10-12 US disclosed
WO-2007104558-A1 THIAZOLES AS NF-KB INHIBITORS (PROTEASOME INHIBITORS) 4SC AG (DE) 2007-09-20 WO disclosed
WO-2007104557-A2 NOVEL HETEROCYCLIC NF-KB INHIBITORS 4SC AG (DE) 2007-09-20 WO disclosed
US-20070219190-A1 Heterocyclic NF-kB Inhibitors 4SC AG (DE) 2007-09-20 US disclosed
EP-1834954-A1 Thiazoles as NF-kB Inhibitors (proteasome inhibitors) 4SC AG (DE) 2007-09-19 EP disclosed
EP-1797084-A1 NOVEL HETEROCYCLIC NF-kB INHIBITORS 4SC AG (DE) 2007-06-20 EP disclosed
WO-2007016979-A2 NOVEL HETEROCYCLIC NF-κB INHIBITORS 4SC AG (DE) 2007-02-15 WO disclosed
US-20060247253-A1 Novel heterocyclic NF-kB inhibitors 4 SC AG (DE) 2006-11-02 US disclosed
WO-2006032322-A1 NOVEL HETEROCYCLIC NF-κB INHIBITORS 4SC AG (DE) 2006-03-30 WO disclosed
US-20060069102-A1 Novel heterocyclic NF-kB inhibitors 4 SC AG (DE) 2006-03-30 US disclosed
EP-1637529-A1 Novel piperidin-4-yl-thiazole-carboxamide analogues as inhibitors of T-cell proliferation and uses thereof 4SC AG (DE) 2006-03-22 EP 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 (6 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-20100267717-A1 Novel Heterocyclic NF-kB Inhibitors NFKB2, NFKBIA, NFRKB SMYD3 1714/4885UTS2R 836/4885MCHR1 3580/4885
US-20110052532-A1 Pharmaceutical composition comprising a cytokine IL2, IL17A, IFNG SMYD3 4868/4885UTS2R 4380/4885MCHR1 814/4885
US-20070219190-A1 Heterocyclic NF-kB Inhibitors NFKBIA, NFKB2, NFRKB SMYD3 2428/4885UTS2R 1517/4885MCHR1 3063/4885
US-20060247253-A1 Novel heterocyclic NF-kB inhibitors NFKBIA, NFRKB, NFKB2 SMYD3 2968/4885UTS2R 2096/4885MCHR1 3308/4885
US-20120022068-A1 NOVEL HETEROCYCLIC NF-kB INHIBITORS NFKB2, NFKBIA, NFRKB SMYD3 1714/4885UTS2R 836/4885MCHR1 3580/4885
US-20060069102-A1 Novel heterocyclic NF-kB inhibitors NFKBIA, NFKB2, NFRKB SMYD3 2305/4885UTS2R 1436/4885MCHR1 2721/4885

“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.