SCHEMBL2385160

SCHEMBL2385160

CC(O)[C@@H](Nc1ccc(C#N)c2sccc12)C(=O)NNC(=O)c1ccc(F)cc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.34
KDM4E B2RXH2 1/20 0.34
RAB9A P51151 3/20 0.33
CTSL P07711 3/20 0.33
MAPK10 P53779 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.31
ATM Q13315 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
MAOA P21397 1/20 0.31

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
SCHEMBL1363856 1.00 GAA (0.34) GAAKDM4ERAB9ACTSLMAPK10
SCHEMBL1364611 1.00 GAA (0.34) GAAKDM4ERAB9ACTSLMAPK10
SCHEMBL1363886 0.91 POLB (0.39) GAAKDM4ESMN1; SMN2ALDH1A1MAOA
SCHEMBL1366023 0.91 POLB (0.39) GAAKDM4ESMN1; SMN2ALDH1A1MAOA
SCHEMBL1364446 0.90 RAB9A (0.34) GAAKDM4ERAB9ACTSLMAPK10
SCHEMBL1363809 0.90 RAB9A (0.34) GAAKDM4ERAB9ACTSLMAPK10
SCHEMBL12138721 0.83 GAA (0.34) GAAKDM4ERAB9ASMN1; SMN2NPC1
SCHEMBL12138708 0.83 GAA (0.34) GAAKDM4ERAB9ASMN1; SMN2NPC1
SCHEMBL12306852 0.80 SMN1; SMN2 (0.36) GAAKDM4ERAB9ACTSLMAPK10
SCHEMBL1363401 0.80 AR (0.42) CTSLSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110224267-A1 Selective androgen receptor modulators Radius Health,Inc. (US) 2011-09-15 US disclosed
US-20090253758-A1 Selective androgen receptor modulators ELLIPSES PHARMA LTD (GB) 2009-10-08 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 (2 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-20110224267-A1 Selective androgen receptor modulators AR, SHBG, GPR119 GAA 4131/4885KDM4E 1482/4885RAB9A 4321/4885
US-20090253758-A1 Selective androgen receptor modulators AR, SHBG, GPR119 GAA 4131/4885KDM4E 1482/4885RAB9A 4321/4885

“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.