SCHEMBL6455701

SCHEMBL6455701

Cc1cc(NC(=O)C(NC(=O)c2ccc(Cl)s2)c2cccnc2)ccc1N1CCCN(C)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 14/20 0.45
NPC1 O15118 2/20 0.43
ALDH1A1 P00352 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
THRB P10828 1/20 0.42
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
REV1 Q9UBZ9 1/20 0.39

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
SCHEMBL6461335 0.91 F10 (0.51) F10NPC1ALDH1A1RAB9AHTT
SCHEMBL3027441 0.83 F10 (0.47) F10NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL4462995 0.81 F10 (0.72) F10
SCHEMBL5563818 0.79 NPC1 (0.42) F10NPC1ALDH1A1RAB9ALMNA
SCHEMBL6454341 0.78 F10 (0.56) F10NPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL6459829 0.78 F10 (0.55) F10MAPTMEN1KMT2A
SCHEMBL6460477 0.77 F10 (0.54) F10LMNAMAPK1KMT2A
SCHEMBL6460670 0.77 F10 (0.50) F10
SCHEMBL6457776 0.76 F10 (0.57) F10NPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL6460727 0.74 F10 (0.51) F10NPC1ALDH1A1RAB9ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050256107-A1 New substituted thiophene carboxamides, process for their preparation and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-11-17 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-20050256107-A1 New substituted thiophene carboxamides, process for their preparation and their use as medicaments OTC, TPMT, ABCG2 F10 1901/4885NPC1 1752/4885ALDH1A1 1734/4885

“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.