SCHEMBL16677014

SCHEMBL16677014

CCOC(=O)Cc1nc2ccc(C)cc2s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.60
RAB9A P51151 8/20 0.55
NPC1 O15118 7/20 0.55
SMN1; SMN2 Q16637 5/20 0.55
ALDH1A1 P00352 4/20 0.55
TP53 P04637 3/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MAPT P10636 5/20 0.53
KDM4E B2RXH2 3/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
GAA P10253 1/20 0.53
DYRK1A Q13627 1/20 0.51
KLF5 Q13887 1/20 0.48
HPGD P15428 2/20 0.48
SHMT2 P34897 1/20 0.48
ACP1 P24666 1/20 0.48
CSNK1D P48730 1/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 2/20 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
SCHEMBL11325797 0.87 RAB9A (0.59) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL489108 0.86 RAB9A (0.52) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL12597420 0.86 MAPT (0.51) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL16674773 0.85 DYRK1A (0.60) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL11313450 0.85 SMN1; SMN2 (0.56) RAB9ANPC1SMN1; SMN2ALDH1A1TP53
SCHEMBL15413106 0.85 SMN1; SMN2 (0.52) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL11324535 0.85 SMN1; SMN2 (0.57) RAB9ANPC1SMN1; SMN2ALDH1A1TP53
SCHEMBL12210613 0.83 LIPG (0.57) RAB9ANPC1SMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL29647831 0.83 MAPT (0.75) RAB9ANPC1SMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL3100413 0.83 MAPT (0.75) RAB9ANPC1SMN1; SMN2ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE47689-E1 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2019-11-05 US disclosed
US-9617268-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2017-04-11 US disclosed
US-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY F. HOFFMANN-LA ROCHE AG (CH) 2015-04-30 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 (1 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-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, RBM17, RBM22 PTPN1 4793/4885RAB9A 3292/4885NPC1 4329/4885

“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.