SCHEMBL22854872

SCHEMBL22854872

O=C(O)CC[C@H](NC(=O)N[C@@H](CCC(=O)NCCCCCCCC(=O)N[C@@H](CCc1ccccc1)CN[C@@H](Cc1ccccc1)C(=O)NCCNC(=S)Nc1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1)C(=O)O)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.52
▸ ALB P02768 2/20 0.50
▸ CA9 Q16790 7/20 0.49
▸ CA1 P00915 6/20 0.49
▸ CA2 P00918 6/20 0.49
▸ CA12 O43570 5/20 0.49
▸ CA14 Q9ULX7 2/20 0.49
▸ CA7 P43166 1/20 0.49
▸ FKBP1A P62942 1/20 0.46
▸ HTR3A P46098 2/20 0.45
▸ HTRA2 O43464 3/20 0.44
▸ HTRA1 Q92743 3/20 0.44
▸ ELF3 P78545 1/20 0.43
▸ MED23 Q9ULK4 1/20 0.43
▸ HDAC3 O15379 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ NCOR2 Q9Y618 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
SCHEMBL26230948 0.96 FOLH1 (0.53) FOLH1ALBCA9CA1CA2
SCHEMBL21183304 0.93 FOLH1 (0.53) FOLH1ALBCA9CA1CA2
SCHEMBL20843781 0.92 FOLH1 (0.56) FOLH1ALBCA9CA1CA2
SCHEMBL17245299 0.92 FOLH1 (0.56) FOLH1ALBCA9CA1CA2
SCHEMBL15505788 0.91 FOLH1 (0.54) FOLH1ALBCA9CA1CA2
SCHEMBL26230941 0.91 FOLH1 (0.46) FOLH1ALBCA9CA1CA2
SCHEMBL21183297 0.90 FOLH1 (0.54) FOLH1ALBCA9CA1CA2
SCHEMBL22414021 0.89 FOLH1 (0.54) FOLH1ALBCA9CA1CA2
SCHEMBL20622392 0.89 FOLH1 (0.54) FOLH1ALBCA9CA1CA2
SCHEMBL17245794 0.88 FOLH1 (0.55) FOLH1ALBCA9CA1CA2

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-11759480-B2 Compositions and methods for CAR T cell therapy ENDOCYTE, INC. (US) 2023-09-19 — — US disclosed
US-20200405760-A1 COMPOSITIONS AND METHODS FOR CAR T CELL THERAPY ENDOCYTE, INC. 2020-12-31 — — 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-11759480-B2 Compositions and methods for CAR T cell therapy CD47, PBK, GZMB FOLH1 186/4885ALB 2876/4885CA9 542/4885
US-20200405760-A1 COMPOSITIONS AND METHODS FOR CAR T CELL THERAPY CD47, PBK, GZMB FOLH1 186/4885ALB 2876/4885CA9 542/4885

“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.

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