SCHEMBL3402415

SCHEMBL3402415

Cc1ccc(F)c(-c2nc(C)c(C(=O)N3CCC(N4CCCCCC4)CC3)s2)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.50
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
L3MBTL1 Q9Y468 6/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
L3MBTL3 Q96JM7 6/20 0.45
LMNA P02545 1/20 0.44
MBTD1 Q05BQ5 3/20 0.44
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
CES2 O00748 1/20 0.43
HRH3 Q9Y5N1 2/20 0.42
TDP1 Q9NUW8 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
SCHEMBL3405642 1.00 HTR2C (0.50) HTR2CMEN1KMT2AL3MBTL1KDM4E
SCHEMBL3401249 0.94 HTR2C (0.50) HTR2CMEN1KMT2AL3MBTL1KDM4E
SCHEMBL3405840 0.94 HTR2C (0.50) HTR2CMEN1KMT2AL3MBTL1KDM4E
SCHEMBL3404916 0.92 L3MBTL1 (0.50) HTR2CMEN1KMT2AL3MBTL1KDM4E
SCHEMBL3404782 0.92 L3MBTL1 (0.50) HTR2CMEN1KMT2AL3MBTL1KDM4E
SCHEMBL3404973 0.91 HTR2C (0.46) HTR2CALDH1A1LMNATHRATHRB
SCHEMBL3402596 0.90 HTR2C (0.52) HTR2CL3MBTL1L3MBTL3LMNAMBTD1
SCHEMBL3405098 0.90 HTR2C (0.52) HTR2CL3MBTL1L3MBTL3LMNAMBTD1
SCHEMBL14546034 0.89 HTR2C (0.51) HTR2CL3MBTL1L3MBTL3LMNAMBTD1
SCHEMBL3405842 0.89 HTR2C (0.53) HTR2CMEN1KMT2AL3MBTL1KDM4E

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 416/4885MEN1 1347/4885KMT2A 890/4885

“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.