SCHEMBL9696078

SCHEMBL9696078

CC(C)(C)N[C@H](CCC(=O)N[C@H](CCC(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 9/20 0.55
NAALAD2 Q9Y3Q0 2/20 0.55
RIMKLA Q8IXN7 1/20 0.55
NOD1 Q9Y239 2/20 0.50
GNPAT O15228 1/20 0.47
GGH Q92820 1/20 0.44
EPHX2 P34913 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
SCHEMBL29324448 1.00 FOLH1 (0.55) FOLH1NAALAD2RIMKLANOD1GNPAT
SCHEMBL9697168 1.00 FOLH1 (0.55) FOLH1NAALAD2RIMKLANOD1GNPAT
SCHEMBL22315438 0.92 FOLH1 (0.50) FOLH1NAALAD2RIMKLANOD1GNPAT
SCHEMBL5575587 0.89 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGGH
SCHEMBL1248320 0.89 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGGH
SCHEMBL9696087 0.89 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGGH
SCHEMBL24918919 0.88 FOLH1 (0.43) FOLH1NAALAD2RIMKLANOD1GNPAT
Hydrochloric Acid SCHEMBL5575609 0.88 FOLH1 (0.53) FOLH1NAALAD2RIMKLAGGH
Hydrochloric Acid SCHEMBL5575602 0.88 FOLH1 (0.53) FOLH1NAALAD2RIMKLAGGH
SCHEMBL22308518 0.87 NOD1 (0.48) FOLH1NAALAD2RIMKLANOD1GNPAT

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-12018093-B2 Hemiasterlin derivatives and antibody-drug conjugates including same Sumitomo Pharma Co., Ltd. (JP) 2024-06-25 US disclosed
US-20200247845-A1 Hemiasterlin Derivatives and Antibody-Drug Conjugates Including Same SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-08-06 US disclosed
EP-0509643-A1 Anti-cancer compounds BTG INTERNATIONAL LIMITED (GB) 1992-10-21 EP 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-20200247845-A1 Hemiasterlin Derivatives and Antibody-Drug Conjugates Including Same FCGRT, QARS1, INHA FOLH1 4072/4885NAALAD2 984/4885RIMKLA 1754/4885
US-12018093-B2 Hemiasterlin derivatives and antibody-drug conjugates including same FCGRT, QARS1, INHA FOLH1 4072/4885NAALAD2 984/4885RIMKLA 1754/4885

“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.