SCHEMBL19253768

SCHEMBL19253768

Nc1nc2cnc(C(F)(F)F)cc2s1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 4/20 0.62
PI4KA P42356 4/20 0.62
PIK3CG P48736 4/20 0.62
PI4KB Q9UBF8 4/20 0.62
PIK3CA P42336 3/20 0.62
PIK3CB P42338 3/20 0.62
SCN4A P35499 3/20 0.54
EPHX2 P34913 1/20 0.54
RAB9A P51151 4/20 0.46
CYP3A4 P08684 4/20 0.46
NPC1 O15118 3/20 0.46
TP53 P04637 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HSD17B10 Q99714 3/20 0.46
LMNA P02545 2/20 0.46
PKM P14618 2/20 0.46
GAA P10253 2/20 0.46
CYP1A2 P05177 2/20 0.46
KCNH2 Q12809 1/20 0.46
GMNN O75496 1/20 0.46

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
SCHEMBL20101125 0.86 PIK3CD (0.58) PIK3CDPI4KAPIK3CGPI4KBPIK3CA
SCHEMBL10183352 0.83 RAB9A (0.50) PIK3CDPI4KAPIK3CGPI4KBPIK3CA
SCHEMBL20101061 0.79 MEN1 (0.50) PIK3CDPI4KAPIK3CGPI4KBPIK3CA
SCHEMBL25307122 0.77 PI4KA (1.00) PIK3CDPI4KAPIK3CGPI4KBPIK3CA
SCHEMBL31114551 0.77 PI4KA (1.00) PIK3CDPI4KAPIK3CGPI4KBPIK3CA
SCHEMBL25493442 0.75 PI4KA (0.67) PIK3CDPI4KAPIK3CGPI4KBPIK3CA
SCHEMBL19270394 0.73 PIK3CD (0.59) PIK3CDPI4KAPIK3CGPI4KBPIK3CA
SCHEMBL3711581 0.73 ALDH1A1 (0.48) PIK3CDPI4KAPIK3CGPI4KBPIK3CA
SCHEMBL29924638 0.73 ALDH1A1 (0.48) PIK3CDPI4KAPIK3CGPI4KBPIK3CA
SCHEMBL21186294 0.71 RAB9A (0.59) PIK3CDPI4KAPIK3CGPI4KBPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10420753-B2 Combination therapies for treatment of spinal muscular atrophy INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2019-09-24 US disclosed
US-10420753-B2 Combination therapies for treatment of spinal muscular atrophy INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2019-09-24 US disclosed
EP-3419981-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY Indiana University Research & Technology Corporation (US) 2019-01-02 EP disclosed
US-20180235943-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2018-08-23 US disclosed
WO-2018081612-A1 COMPOUNDS AND METHODS FOR TREATING CANCER ACTAVALON, INC. (US) 2018-05-03 WO disclosed
US-9895358-B2 Combination therapies for treatment of spinal muscular atrophy INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2018-02-20 US disclosed
US-9895358-B2 Combination therapies for treatment of spinal muscular atrophy INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2018-02-20 US disclosed
WO-2017147312-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORPORATION (US) 2017-08-31 WO disclosed
WO-2017147312-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORPORATION (US) 2017-08-31 WO disclosed
US-20170239225-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2017-08-24 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 (3 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-20180235943-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY SMN1; SMN2, MUSK, MYOF PIK3CD 3371/4885PI4KA 3490/4885PIK3CG 2794/4885
US-10420753-B2 Combination therapies for treatment of spinal muscular atrophy SMN1; SMN2, MUSK, MYOF PIK3CD 3371/4885PI4KA 3490/4885PIK3CG 2794/4885
US-20170239225-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY SMN1; SMN2, MUSK, MYOF PIK3CD 3371/4885PI4KA 3490/4885PIK3CG 2794/4885

“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.