SCHEMBL19253643

SCHEMBL19253643

O=C(Nc1nc2cnc(C(F)(F)F)cc2s1)c1ccns1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.43
DYRK1A Q13627 2/20 0.42
NPC1 O15118 10/20 0.42
RAB9A P51151 10/20 0.42
SMN1; SMN2 Q16637 8/20 0.42
KDM4E B2RXH2 5/20 0.42
HTT P42858 4/20 0.42
MAPT P10636 3/20 0.42
PKM P14618 3/20 0.42
NFKB1 P19838 3/20 0.42
NFKB2 Q00653 3/20 0.42
RELA Q04206 3/20 0.42
POLB P06746 2/20 0.42
OPRK1 P41145 2/20 0.42
AGTR1 P30556 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PIK3CA P42336 2/20 0.41
CYP3A4 P08684 1/20 0.41
TP53 P04637 5/20 0.41
MEN1 O00255 4/20 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
SCHEMBL19270366 0.83 NPC1 (0.46) ABL1DYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL19253710 0.81 RAB9A (0.47) ABL1DYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL19253621 0.81 NPC1 (0.42) ABL1DYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL19253659 0.81 RAB9A (0.65) NPC1RAB9ASMN1; SMN2KDM4EHTT
SCHEMBL19253774 0.81 LRRK2 (0.61) ABL1DYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL19253738 0.80 MEN1 (0.45) ABL1DYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL19253641 0.80 NPC1 (0.48) ABL1DYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL19253628 0.80 ABL1 (0.43) ABL1DYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL19253695 0.80 NPC1 (0.59) NPC1RAB9ASMN1; SMN2KDM4EHTT
SCHEMBL19253769 0.79 SCD (0.63) NPC1RAB9ASMN1; SMN2KDM4EHTT

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 8 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
US-20180235943-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2018-08-23 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
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
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 ABL1 2209/4885DYRK1A 4416/4885NPC1 4242/4885
US-10420753-B2 Combination therapies for treatment of spinal muscular atrophy SMN1; SMN2, MUSK, MYOF ABL1 2209/4885DYRK1A 4416/4885NPC1 4242/4885
US-20170239225-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY SMN1; SMN2, MUSK, MYOF ABL1 2209/4885DYRK1A 4416/4885NPC1 4242/4885

“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.