SCHEMBL3398514

SCHEMBL3398514

CCN(CC)C1CCN(C(=O)c2sc(-c3ccc(Cl)cc3Cl)nc2C)C1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
HTR2C P28335 7/20 0.44
MCHR1 Q99705 1/20 0.42
THRB P10828 1/20 0.41
POLR1A O95602 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
DPP4 P27487 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
CDC7 O00311 1/20 0.38
DBF4 Q9UBU7 1/20 0.38
PPARA Q07869 2/20 0.38
PPARD Q03181 1/20 0.38

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
SCHEMBL3403708 0.94 KDM4E (0.48) KDM4EMAPTHTR2CMCHR1THRB
SCHEMBL3401208 0.93 HTR2C (0.44) KDM4EMAPTHTR2CTHRBPOLR1A
SCHEMBL3402535 0.89 HTR2C (0.52) MAPTHTR2CMCHR1POLR1ACNR1
SCHEMBL3404372 0.88 HTR2C (0.41) HTR2CTHRBPOLR1A
SCHEMBL3402247 0.87 HTR2C (0.47) KDM4EMAPTHTR2CTHRBCNR1
SCHEMBL3405078 0.87 HTR2C (0.47) KDM4EMAPTHTR2CMCHR1THRB
SCHEMBL3398510 0.85 HTR2C (0.50) MAPTHTR2CPOLR1APPARAPPARD
SCHEMBL3401299 0.84 ACKR3 (0.47) HTR2CPOLR1A
SCHEMBL3405373 0.84 THRA (0.44) KDM4EHTR2CTHRBPOLR1ACNR1
SCHEMBL3401811 0.84 HTR2C (0.45) HTR2CTHRBPOLR1ACNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100297035-A1 Thiazole Amides, Imidazole Amides and Related Analogues LIGAND PHARMACEUTICALS, INC. (US) 2010-11-25 US disclosed
US-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed
US-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed
WO-2006089076-A9 THIAZOLE AMIDES, IMIDAZOLE AMIDES AND RELATED ANALOGUES NEUROGEN CORP (US) 2007-04-26 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-20100297035-A1 Thiazole Amides, Imidazole Amides and Related Analogues HRH3, HRH4, HRH2 KDM4E 3449/4885MAPT 342/4885HTR2C 416/4885

“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.