SCHEMBL30040313

SCHEMBL30040313

CCOC(=O)c1ccc([C@H](N)CO)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.48
CA2 P00918 4/20 0.48
CA12 O43570 3/20 0.48
CA7 P43166 3/20 0.48
CA9 Q16790 3/20 0.48
CA14 Q9ULX7 3/20 0.48
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAOA P21397 1/20 0.46
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
HSD17B2 P37059 1/20 0.43
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 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
SCHEMBL20768545 1.00 CA1 (0.48) CA1CA2CA12CA7CA9
SCHEMBL19347437 1.00 CA1 (0.48) CA1CA2CA12CA7CA9
SCHEMBL19347774 0.86 CA1 (0.50) CA1CA2CA12CA7CA9
SCHEMBL19347921 0.86 CA1 (0.50) CA1CA2CA12CA7CA9
SCHEMBL20768595 0.86 CA1 (0.50) CA1CA2CA12CA7CA9
SCHEMBL20768660 0.83 CA1 (0.48) CA1CA2CA12CA7CA9
SCHEMBL19347288 0.83 CA1 (0.48) CA1CA2CA12CA7CA9
SCHEMBL6929080 0.82 HSD17B2 (0.59) CA1CA2CA12CA7CA9
SCHEMBL26325510 0.81 CA12 (0.51) CA1CA2CA12CA7CA9
SCHEMBL20768576 0.79 GRM1 (0.45) LMNACYP1A2MEN1KMT2AKDM4E

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-20230348386-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. 2023-11-02 US disclosed
US-11535593-B2 3-phosphoglycerate dehydrogenase inhibitors and uses thereof RAZE THERAPEUTICS, INC. (US) 2022-12-27 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-20230348386-A1 3-PHOSPHOGLYCERATE DEHYDROGENASE INHIBITORS AND USES THEREOF PHGDH, G6PD, PGD CA1 1552/4885CA2 806/4885CA12 1863/4885
US-11535593-B2 3-phosphoglycerate dehydrogenase inhibitors and uses thereof PHGDH, G6PD, PGD CA1 1552/4885CA2 806/4885CA12 1863/4885

“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.