SCHEMBL3404035

SCHEMBL3404035

Cc1nc(-c2c(F)cccc2F)sc1C(=O)N1CCN(C(C)C)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 8/20 0.50
CNR1 P21554 1/20 0.48
PARP1 P09874 2/20 0.43
CES2 O00748 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HRH3 Q9Y5N1 2/20 0.38
SIGLEC9 Q9Y336 1/20 0.38
MAPT P10636 1/20 0.38
TRPM8 Q7Z2W7 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
SCHEMBL3400042 0.89 HTR2C (0.58) HTR2CCNR1PARP1CES2LMNA
SCHEMBL3405573 0.88 HTR2C (0.52) HTR2CCNR1PARP1CES2MEN1
SCHEMBL3403332 0.88 HTR2C (0.55) HTR2CCNR1PARP1CES2LMNA
SCHEMBL13071980 0.86 CNR1 (0.42) HTR2CCNR1PARP1MEN1KMT2A
SCHEMBL3402656 0.84 HTR2C (0.48) HTR2CCNR1PARP1LMNATSHR
SCHEMBL3404377 0.84 TRPM8 (0.57) HTR2CCNR1KMT2ATRPM8
SCHEMBL3399685 0.83 CNR1 (0.55) HTR2CCNR1HRH3MAPTTRPM8
SCHEMBL3401781 0.82 CNR1 (0.70) HTR2CCNR1PARP1LMNANPSR1
SCHEMBL3398373 0.82 CNR1 (0.49) HTR2CCNR1PARP1KMT2ATRPM8
SCHEMBL3405446 0.81 CNR1 (0.47) HTR2CCNR1PARP1HTTMEN1

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 6 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
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 416/4885CNR1 35/4885PARP1 4836/4885

“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.