SCHEMBL3396887

SCHEMBL3396887

Cc1nc(-c2cc(F)ccc2F)sc1C(=O)NCCCN1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.48
GAA P10253 1/20 0.47
SMYD2 Q9NRG4 5/20 0.46
MKNK2 Q9HBH9 3/20 0.45
MAPT P10636 2/20 0.45
ULK1 O75385 1/20 0.44
STAT3 P40763 2/20 0.43
KMT2A Q03164 2/20 0.43
PDGFRB P09619 1/20 0.43
KIT P10721 1/20 0.43
KDR P35968 1/20 0.43
NAMPT P43490 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
SCHEMBL3401280 0.94 RAB9A (0.48) RAB9AGAASMYD2MKNK2MAPT
SCHEMBL3401313 0.94 SCN9A (0.47) STAT3PDGFRBKITKDR
SCHEMBL3405360 0.93 SCN9A (0.49) GAASTAT3PDGFRBKITKDR
SCHEMBL3404848 0.91 RAB9A (0.45) RAB9AGAASMYD2MKNK2MAPT
SCHEMBL3405409 0.88 SCN9A (0.47) RAB9ASTAT3PDGFRBKDR
SCHEMBL3401224 0.87 SCN9A (0.49) RAB9AGAASTAT3
SCHEMBL3402585 0.86 DRD2 (0.47) SMYD2MKNK2
SCHEMBL3400482 0.86 DRD2 (0.46) GAASMYD2MAPTKMT2A
SCHEMBL3405260 0.85 GAA (0.48) GAASMYD2MAPTKMT2A
SCHEMBL3402417 0.83 CHRM4 (0.49) RAB9AGAAMAPTKMT2A

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 RAB9A 2102/4885GAA 1659/4885SMYD2 3691/4885

“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.