SCHEMBL19253659

SCHEMBL19253659

O=C(Nc1nc2cnc(C(F)(F)F)cc2s1)c1ccccn1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.65
NPC1 O15118 9/20 0.65
HTT P42858 6/20 0.65
MAPT P10636 6/20 0.65
SMN1; SMN2 Q16637 5/20 0.65
OPRK1 P41145 4/20 0.65
PKM P14618 4/20 0.65
AGTR1 P30556 2/20 0.65
POLB P06746 2/20 0.65
TDP1 Q9NUW8 1/20 0.65
KMT2A Q03164 4/20 0.56
NPSR1 Q6W5P4 1/20 0.56
MEN1 O00255 3/20 0.55
ALDH1A1 P00352 2/20 0.55
LMNA P02545 2/20 0.55
KDM4E B2RXH2 2/20 0.54
CRHBP P24387 1/20 0.54
CRHR2 Q13324 1/20 0.54
SCD O00767 1/20 0.50
GRM4 Q14833 7/20 0.48

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
SCHEMBL19253710 0.87 RAB9A (0.47) RAB9ANPC1HTTMAPTSMN1; SMN2
SCHEMBL19253774 0.86 LRRK2 (0.61) RAB9ANPC1HTTMAPTSMN1; SMN2
SCHEMBL19253641 0.85 NPC1 (0.48) RAB9ANPC1HTTMAPTSMN1; SMN2
SCHEMBL19253770 0.84 RAB9A (0.45) RAB9ANPC1HTTMAPTSMN1; SMN2
SCHEMBL19253669 0.83 NPC1 (0.44) RAB9ANPC1HTTMAPTSMN1; SMN2
SCHEMBL19270374 0.82 RAB9A (0.72) RAB9ANPC1HTTMAPTSMN1; SMN2
SCHEMBL19253769 0.82 SCD (0.63) RAB9ANPC1HTTMAPTSMN1; SMN2
SCHEMBL19253666 0.82 RAB9A (0.43) RAB9ANPC1HTTMAPTSMN1; SMN2
SCHEMBL19253741 0.82 NPC1 (0.44) RAB9ANPC1HTTMAPTSMN1; SMN2
SCHEMBL19253605 0.82 LRRK2 (0.63) RAB9ANPC1MAPTSMN1; SMN2POLB

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 RAB9A 2194/4885NPC1 4242/4885HTT 337/4885
US-10420753-B2 Combination therapies for treatment of spinal muscular atrophy SMN1; SMN2, MUSK, MYOF RAB9A 2194/4885NPC1 4242/4885HTT 337/4885
US-20170239225-A1 COMBINATION THERAPIES FOR TREATMENT OF SPINAL MUSCULAR ATROPHY SMN1; SMN2, MUSK, MYOF RAB9A 2194/4885NPC1 4242/4885HTT 337/4885

“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.