SCHEMBL19253666

SCHEMBL19253666

O=C(Nc1nc2cnc(C(F)(F)F)cc2s1)c1ccon1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.43
NPC1 O15118 8/20 0.43
SMN1; SMN2 Q16637 6/20 0.43
MAPT P10636 5/20 0.43
HTT P42858 4/20 0.43
PKM P14618 2/20 0.43
POLB P06746 2/20 0.43
OPRK1 P41145 2/20 0.43
AGTR1 P30556 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ABL1 P00519 1/20 0.43
TP53 P04637 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
USP2 O75604 1/20 0.42
KCNH2 Q12809 2/20 0.42
RAF1 P04049 1/20 0.42
BRAF P15056 1/20 0.42
DYRK1A Q13627 2/20 0.41
KDM4E B2RXH2 3/20 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
SCHEMBL19270363 0.83 MAPT (0.50) RAB9ANPC1SMN1; SMN2MAPTHTT
SCHEMBL19253758 0.83 RAB9A (0.58) RAB9ANPC1SMN1; SMN2MAPTHTT
SCHEMBL19253659 0.82 RAB9A (0.65) RAB9ANPC1SMN1; SMN2MAPTHTT
SCHEMBL19253669 0.81 NPC1 (0.44) RAB9ANPC1SMN1; SMN2MAPTHTT
SCHEMBL19253641 0.81 NPC1 (0.48) RAB9ANPC1SMN1; SMN2MAPTHTT
SCHEMBL19253624 0.81 RAB9A (0.42) RAB9ANPC1SMN1; SMN2MAPTHTT
SCHEMBL19253741 0.80 NPC1 (0.44) RAB9ANPC1SMN1; SMN2MAPTHTT
SCHEMBL19253605 0.80 LRRK2 (0.63) RAB9ANPC1SMN1; SMN2MAPTPOLB
SCHEMBL19253770 0.80 RAB9A (0.45) RAB9ANPC1SMN1; SMN2MAPTHTT
SCHEMBL19253774 0.80 LRRK2 (0.61) RAB9ANPC1SMN1; SMN2MAPTHTT

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 RAB9A 2194/4885NPC1 4242/4885SMN1; SMN2 1/4885
US-10420753-B2 Combination therapies for treatment of spinal muscular atrophy SMN1; SMN2, MUSK, MYOF RAB9A 2194/4885NPC1 4242/4885SMN1; SMN2 1/4885
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.