SCHEMBL3399445

SCHEMBL3399445

Cc1nc(-c2ccc(F)c(Cl)c2)sc1C(=O)N1CCC(N2CCCCC2)CC1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.52
THRA P10827 2/20 0.50
THRB P10828 2/20 0.50
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HTR2C P28335 1/20 0.44
CNR1 P21554 1/20 0.44
LRRK2 Q5S007 1/20 0.44
L3MBTL1 Q9Y468 6/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
L3MBTL3 Q96JM7 5/20 0.43
LMNA P02545 1/20 0.43
OXTR P30559 1/20 0.42
HSP90AA1 P07900 1/20 0.42
MAPT P10636 1/20 0.42
MET P08581 1/20 0.42
MBTD1 Q05BQ5 3/20 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
SCHEMBL3399760 1.00 HRH3 (0.52) HRH3THRATHRBMEN1KMT2A
SCHEMBL3402095 0.93 THRA (0.50) HRH3THRATHRBMEN1KMT2A
SCHEMBL3402165 0.93 THRA (0.50) HRH3THRATHRBMEN1KMT2A
SCHEMBL3406141 0.91 THRA (0.47) HRH3THRATHRBHTR2CCNR1
SCHEMBL3398363 0.91 THRA (0.52) HRH3THRATHRBHTR2CCNR1
SCHEMBL3400277 0.91 THRA (0.52) HRH3THRATHRBMEN1KMT2A
SCHEMBL3399934 0.91 THRA (0.52) HRH3THRATHRBMEN1KMT2A
SCHEMBL3404745 0.90 THRA (0.52) HRH3THRATHRBMEN1KMT2A
SCHEMBL3401293 0.90 THRA (0.52) HRH3THRATHRBMEN1KMT2A
SCHEMBL3402620 0.89 THRA (0.52) HRH3THRATHRBMEN1KMT2A

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 HRH3 1/4885THRA 38/4885THRB 60/4885

“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.