SCHEMBL3400835

SCHEMBL3400835

Cc1nc(-c2cccc(Cl)c2Cl)sc1C(=O)N1CCN(C2CCCC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 12/20 0.53
ALDH1A1 P00352 3/20 0.46
HPGD P15428 1/20 0.46
CNR1 P21554 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.42
HSP90AA1 P07900 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL3398198 0.92 HTR2C (0.55) HTR2CALDH1A1HPGDCNR1L3MBTL1
SCHEMBL3404914 0.91 HTR2C (0.58) HTR2CALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL3400795 0.91 HTR2C (0.58) HTR2CALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL3400254 0.86 HTR2C (0.55) HTR2CALDH1A1HPGDCNR1L3MBTL1
SCHEMBL3405829 0.85 HTR2C (0.57) HTR2CALDH1A1HPGDCNR1L3MBTL1
SCHEMBL3401746 0.85 HTR2C (0.75) HTR2CALDH1A1HPGDCNR1KDM4E
SCHEMBL3400300 0.85 HTR2C (0.56) HTR2CALDH1A1HPGDCNR1KDM4E
SCHEMBL3405168 0.84 HTR2C (0.46) HTR2CALDH1A1HPGDCNR1L3MBTL1
SCHEMBL3397030 0.84 HTR2C (0.46) HTR2CALDH1A1HPGDCNR1L3MBTL1
SCHEMBL3405379 0.84 HTR2C (0.53) HTR2CALDH1A1HPGDCNR1KDM4E

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-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
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 HTR2C 416/4885ALDH1A1 916/4885HPGD 1057/4885

“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.