SCHEMBL3402104

SCHEMBL3402104

CCN(C)CCN(CC)C(=O)c1sc(-c2ccc(C)c3ccccc23)nc1C

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 12/20 0.53
ALDH1A1 P00352 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 1/20 0.40
LMNA P02545 1/20 0.39
KMT2A Q03164 2/20 0.38
CD274 Q9NZQ7 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 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
SCHEMBL3404364 0.90 HTR2C (0.51) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3402983 0.89 HTR2C (0.68) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3403644 0.85 HTR2C (0.49) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3406004 0.85 HTR2C (0.49) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3402572 0.84 HTR2C (0.48) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3402218 0.84 HTR2C (0.41) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL13310314 0.82 HTR2C (0.41) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3404329 0.82 CRHR1 (0.44) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3400468 0.82 HTR2C (0.40) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL13071984 0.82 HTR2C (0.40) HTR2CALDH1A1NPC1RAB9ASMN1; SMN2

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 4 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

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 416/4885ALDH1A1 916/4885NPC1 2005/4885

“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.