SCHEMBL3045372

SCHEMBL3045372

Cc1nc(C=O)sc1C(=O)NCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCD O00767 13/20 0.61
NPC1 O15118 2/20 0.52
HPGD P15428 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 1/20 0.51
RAB9A P51151 1/20 0.51

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
SCHEMBL243885 0.82 SCD (0.65) SCDNPC1HPGDSMN1; SMN2ALDH1A1
SCHEMBL244826 0.81 SCD (0.64) SCDNPC1ALDH1A1RAB9A
SCHEMBL3051532 0.81 SCD (0.64) SCDNPC1HPGDSMN1; SMN2ALDH1A1
SCHEMBL3585867 0.80 NPC1 (0.77) SCDNPC1SMN1; SMN2ALDH1A1RAB9A
SCHEMBL3586148 0.80 SCD (0.73) SCDNPC1HPGDSMN1; SMN2ALDH1A1
SCHEMBL3585303 0.79 SCD (0.61) SCDNPC1HPGDRAB9A
SCHEMBL3046765 0.79 SCD (0.61) SCDNPC1HPGDSMN1; SMN2ALDH1A1
SCHEMBL3052998 0.79 SCD (0.61) SCDNPC1HPGDSMN1; SMN2ALDH1A1
SCHEMBL5360056 0.79 SCD (0.58) SCDNPC1HPGD
SCHEMBL3583154 0.77 SCD (0.76) SCDNPC1HPGDSMN1; SMN2ALDH1A1

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-8258160-B2 SCD1 inhibitors triazole and tetrazole compounds NOVARTIS AG (CH) 2012-09-04 US disclosed
US-8258160-B2 SCD1 inhibitors triazole and tetrazole compounds NOVARTIS AG (CH) 2012-09-04 US disclosed
US-20100029722-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-02-04 US disclosed
US-20100029722-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-02-04 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-20100029722-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 SCD 1/4885NPC1 228/4885HPGD 344/4885

“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.