SCHEMBL3402155

SCHEMBL3402155

COc1ccc(-c2nc(C)c(C(=O)NCCN3CCCC3)s2)cc1F

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 1/20 0.55
SCN9A Q15858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
POLB P06746 1/20 0.45
MAPT P10636 8/20 0.45
LMNA P02545 2/20 0.45
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CHRM4 P08173 3/20 0.44
KMT2A Q03164 1/20 0.43
TP53 P04637 2/20 0.43

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
SCHEMBL3402142 0.94 CD274 (0.48) CD274MAPTLMNA
SCHEMBL3403888 0.92 MAPT (0.53) SMN1; SMN2POLBMAPTLMNANPC1
SCHEMBL3398788 0.91 MAPT (0.48) SMN1; SMN2POLBMAPTLMNANPC1
SCHEMBL3400096 0.89 CHRM4 (0.49) SCN9ASMN1; SMN2MAPTNPC1ALDH1A1
SCHEMBL3400929 0.89 SCN9A (0.49) SCN9ASMN1; SMN2MAPTNPC1CHRM4
SCHEMBL3402600 0.87 CHRM4 (0.49) SCN9ASMN1; SMN2MAPTLMNANPC1
SCHEMBL3400885 0.86 SMN1; SMN2 (0.47) CD274SCN9ASMN1; SMN2POLBMAPT
SCHEMBL3398394 0.86 KDM4E (0.54) SCN9APOLBMAPTLMNAALDH1A1
SCHEMBL3398904 0.85 POLB (0.60) SCN9APOLBMAPTLMNANPC1
SCHEMBL3398921 0.85 SMN1; SMN2 (0.46) CD274SCN9ASMN1; SMN2POLBHSD17B10

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 CD274 1650/4885SCN9A 1350/4885SMN1; SMN2 1605/4885

“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.