SCHEMBL5035161

SCHEMBL5035161

N/C=N/C(=S)Nc1ccc(Cl)cc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.63
RAB9A P51151 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
NPC1 O15118 2/20 0.61
MAPT P10636 2/20 0.52
KDM4E B2RXH2 1/20 0.52
NOX1 Q9Y5S8 1/20 0.44
GAA P10253 2/20 0.43
EPHX1 P07099 1/20 0.42
CNR1 P21554 1/20 0.42
HTT P42858 1/20 0.42
MAPK1 P28482 1/20 0.41
GFER P55789 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL5035164 1.00 ALDH1A1 (0.63) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL15740342 0.76 NPC1 (1.00) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL9725073 0.74 ALDH1A1 (0.66) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL5028936 0.72 SMN1; SMN2 (0.58) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL5030205 0.72 SMN1; SMN2 (0.58) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL526059 0.71 MAPT (0.63) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL5445907 0.71 MAPT (0.75) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL8956455 0.71 MAPT (0.75) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL5032606 0.70 MAPT (0.55) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT
SCHEMBL5032613 0.70 MAPT (0.55) ALDH1A1RAB9ASMN1; SMN2NPC1MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371751-B2 Thiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-05-13 US disclosed
EP-1694673-B1 THIAZOLE DERIVATES HOFFMANN LA ROCHE (CH) 2008-01-16 EP disclosed
US-20050153962-A1 Thiazole derivatives HOFFMANN-LA ROCHE INC. 2005-07-14 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-20050153962-A1 Thiazole derivatives CNR1, CNR2, GPR119 ALDH1A1 473/4885RAB9A 1847/4885SMN1; SMN2 3460/4885

“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.