SCHEMBL19270403

SCHEMBL19270403

Cc1cc2sc(NC(=O)c3ccco3)nc2cn1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 18/20 0.71
▸ NPC1 O15118 17/20 0.71
▸ SMN1; SMN2 Q16637 7/20 0.71
▸ MAPT P10636 2/20 0.71
▸ KMT2A Q03164 2/20 0.71
▸ MEN1 O00255 1/20 0.71
▸ KDM4E B2RXH2 3/20 0.65
▸ CASP3 P42574 2/20 0.65
▸ SENP8 Q96LD8 2/20 0.65
▸ SENP7 Q9BQF6 2/20 0.65
▸ SENP6 Q9GZR1 2/20 0.65
▸ NFKB1 P19838 1/20 0.65
▸ NFKB2 Q00653 1/20 0.65
▸ RELA Q04206 1/20 0.65
▸ TP53 P04637 3/20 0.63
▸ PKM P14618 3/20 0.62
▸ F2 P00734 1/20 0.62
▸ KLF5 Q13887 1/20 0.62
▸ ALDH1A1 P00352 3/20 0.61
▸ HSD17B10 Q99714 2/20 0.61

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
SCHEMBL2244452 0.83 RAB9A (1.00) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL19270362 0.82 NPC1 (0.48) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL19270384 0.81 RAB9A (0.47) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL19270373 0.81 NPC1 (0.63) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL19270397 0.80 NPC1 (0.54) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL19270399 0.80 NPC1 (0.46) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL16334021 0.80 RAB9A (0.87) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL19270363 0.79 MAPT (0.50) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL3049831 0.79 RAB9A (0.77) RAB9ANPC1SMN1; SMN2MAPTKMT2A
SCHEMBL19270374 0.79 RAB9A (0.72) RAB9ANPC1SMN1; SMN2MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9895358-B2 Combination therapies for treatment of spinal muscular atrophy INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2018-02-20 — — US disclosed
US-20170239225-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2017-08-24 — — 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-20170239225-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY SMN1; SMN2, MUSK, MYOF RAB9A 2194/4885NPC1 4242/4885SMN1; SMN2 1/4885

“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.

Send feedback