SCHEMBL19253766

SCHEMBL19253766

O=C(Nc1nc2cnc(C(F)(F)F)cc2s1)c1nccs1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 6/20 0.60
▸ SENP8 Q96LD8 6/20 0.60
▸ SENP7 Q9BQF6 6/20 0.60
▸ SENP6 Q9GZR1 6/20 0.60
▸ ABL1 P00519 1/20 0.42
▸ DYRK1A Q13627 2/20 0.40
▸ NPC1 O15118 8/20 0.40
▸ RAB9A P51151 8/20 0.40
▸ SMN1; SMN2 Q16637 6/20 0.40
▸ HTT P42858 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ PKM P14618 3/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ POLB P06746 2/20 0.40
▸ NFKB1 P19838 2/20 0.40
▸ NFKB2 Q00653 2/20 0.40
▸ RELA Q04206 2/20 0.40
▸ OPRK1 P41145 2/20 0.40
▸ AGTR1 P30556 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL19270382 0.82 CASP3 (0.64) CASP3SENP8SENP7SENP6ABL1
SCHEMBL19253710 0.82 RAB9A (0.47) ABL1DYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL19253659 0.80 RAB9A (0.65) NPC1RAB9ASMN1; SMN2HTTMAPT
SCHEMBL19253621 0.80 NPC1 (0.42) CASP3SENP8SENP7SENP6ABL1
SCHEMBL19253737 0.79 LRRK2 (0.44) ABL1DYRK1ANPC1RAB9ASMN1; SMN2
SCHEMBL19253774 0.79 LRRK2 (0.61) CASP3SENP8SENP7SENP6ABL1
SCHEMBL19270380 0.79 ABL1 (0.41) CASP3SENP8SENP7SENP6ABL1
SCHEMBL19253643 0.79 ABL1 (0.43) CASP3SENP8SENP7SENP6ABL1
SCHEMBL19253628 0.79 ABL1 (0.43) CASP3SENP8SENP7SENP6ABL1
SCHEMBL19253641 0.79 NPC1 (0.48) CASP3SENP8SENP7SENP6ABL1

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 10 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
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 CASP3 2196/4885SENP8 3616/4885SENP7 3472/4885
US-10420753-B2 Combination therapies for treatment of spinal muscular atrophy SMN1; SMN2, MUSK, MYOF CASP3 2196/4885SENP8 3616/4885SENP7 3472/4885
US-20170239225-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY SMN1; SMN2, MUSK, MYOF CASP3 2196/4885SENP8 3616/4885SENP7 3472/4885

“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.

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