SCHEMBL21560102

SCHEMBL21560102

CC(C)C[C@H](NC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SHMT1 P34896 5/20 0.58
SHMT2 P34897 5/20 0.58
LMNA P02545 1/20 0.55
HTT P42858 1/20 0.55
TP53 P04637 2/20 0.54
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 3/20 0.50
CNR2 P34972 1/20 0.48
PDE5A O76074 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TLR7 Q9NYK1 1/20 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
SCHEMBL21560199 1.00 SHMT1 (0.58) SHMT1SHMT2LMNAHTTTP53
SCHEMBL21560233 0.91 LMNA (0.61) SHMT1SHMT2LMNAHTTTP53
SCHEMBL20255720 0.91 LMNA (0.61) SHMT1SHMT2LMNAHTTTP53
SCHEMBL20255933 0.90 SHMT2 (0.72) SHMT1SHMT2LMNAHTTTP53
SCHEMBL20255922 0.90 SHMT2 (0.72) SHMT1SHMT2LMNAHTTTP53
SCHEMBL20255862 0.88 SHMT2 (0.58) SHMT1SHMT2LMNAHTTTP53
SCHEMBL20255817 0.88 SHMT2 (0.58) SHMT1SHMT2LMNAHTTTP53
SCHEMBL20255589 0.87 SHMT1 (0.64) SHMT1SHMT2LMNAHTTALDH1A1
SCHEMBL20255830 0.87 SHMT1 (0.64) SHMT1SHMT2LMNAHTTALDH1A1
SCHEMBL5869530 0.87 ALDH1A1 (0.52) SHMT1SHMT2LMNAHTTTP53

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-11091451-B2 SHMT inhibitors and uses thereof RAZE THERAPEUTICS, INC. (US) 2021-08-17 US disclosed
US-20190345119-A1 SHMT INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. 2019-11-14 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-11091451-B2 SHMT inhibitors and uses thereof SHMT1, SHMT2, BHMT SHMT1 1/4885SHMT2 2/4885LMNA 4283/4885
US-20190345119-A1 SHMT INHIBITORS AND USES THEREOF SHMT1, SHMT2, BHMT SHMT1 1/4885SHMT2 2/4885LMNA 4283/4885

“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.