SCHEMBL19634815

SCHEMBL19634815

CC(C)(C)C(=O)NCc1cccc(C(=O)N2CCN(CC(=O)O)CC2)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
LMNA P02545 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
TSHR P16473 2/20 0.51
MAPK1 P28482 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 5/20 0.47
MAPT P10636 1/20 0.46
MAPK10 P53779 4/20 0.43
KDM4E B2RXH2 2/20 0.43
KCNH2 Q12809 1/20 0.43
MAPK8 P45983 2/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
PARP1 P09874 1/20 0.43
GAA P10253 1/20 0.42

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
SCHEMBL21015335 0.89 LMNA (0.46) MEN1KMT2ALMNASMN1; SMN2TSHR
SCHEMBL21015333 0.88 MEN1 (0.49) MEN1KMT2ALMNASMN1; SMN2TSHR
SCHEMBL21015334 0.87 PARP1 (0.53) MEN1KMT2ALMNASMN1; SMN2TSHR
SCHEMBL21015332 0.87 PARP1 (0.52) MEN1KMT2ALMNASMN1; SMN2TSHR
SCHEMBL21016168 0.86 KDM1A (0.53) MEN1KMT2ALMNASMN1; SMN2TSHR
SCHEMBL21015768 0.86 ALDH1A1 (0.52) MEN1KMT2ALMNASMN1; SMN2MAPK1
SCHEMBL21016164 0.86 RAB9A (0.54) MEN1KMT2ALMNASMN1; SMN2TSHR
SCHEMBL21016169 0.85 HPGD (0.53) MEN1KMT2ALMNASMN1; SMN2TSHR
SCHEMBL21015218 0.84 LMNA (0.53) MEN1KMT2ALMNASMN1; SMN2TSHR
SCHEMBL21016172 0.83 RAB9A (0.55) MEN1KMT2ASMN1; SMN2TSHRL3MBTL1

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-20190151403-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. 2019-05-23 US disclosed
WO-2017200984-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. (US) 2017-11-23 WO 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-20190151403-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF MALT1, MYLK2, FKBP1B MEN1 369/4885KMT2A 4599/4885LMNA 3053/4885

“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.