SCHEMBL18786391

SCHEMBL18786391

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

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.38
▸ CPB2 Q96IY4 2/20 0.38
▸ ITGB3 P05106 8/20 0.37
▸ ITGA2B P08514 8/20 0.37
▸ ATM Q13315 1/20 0.36
▸ CTSK P43235 2/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35

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
SCHEMBL23504916 0.95 FOLH1 (0.50) FOLH1TDP1CPB2ITGB3ITGA2B
SCHEMBL30947360 0.95 FOLH1 (0.50) FOLH1TDP1CPB2ITGB3ITGA2B
SCHEMBL563754 0.95 FOLH1 (0.50) FOLH1TDP1CPB2ITGB3ITGA2B
SCHEMBL14079858 0.95 FOLH1 (0.50) FOLH1TDP1CPB2ITGB3ITGA2B
SCHEMBL563755 0.95 FOLH1 (0.50) FOLH1TDP1CPB2ITGB3ITGA2B
SCHEMBL22147959 0.92 FOLH1 (0.40) FOLH1TDP1CPB2ITGB3ITGA2B
SCHEMBL22878289 0.91 FOLH1 (0.47) FOLH1TDP1CPB2ITGB3ITGA2B
SCHEMBL17997383 0.91 FOLH1 (0.47) FOLH1TDP1CPB2ITGB3ITGA2B
SCHEMBL30485724 0.90 FOLH1 (0.44) FOLH1TDP1CPB2ITGB3ITGA2B
SCHEMBL14680455 0.90 FOLH1 (0.43) FOLH1TDP1CPB2ITGB3ITGA2B

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210154311-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE INC (US) 2021-05-27 — — US disclosed
US-20210154312-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE, INC. 2021-05-27 — — US disclosed
US-20190314515-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE, INC. 2019-10-17 — — US disclosed
US-20170258932-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE INC (US) 2017-09-14 — — US disclosed
US-9636413-B2 Conjugates for treating diseases caused by PSMA expressing cells ENDOCYTE, INC. (US) 2017-05-02 — — US disclosed
US-20170114341-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS BRADSHAW CURT W (US) 2017-04-27 — — 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 (5 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-20210154311-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 FOLH1 1/4885TDP1 2364/4885CPB2 297/4885
US-20210154312-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 FOLH1 1/4885TDP1 2364/4885CPB2 297/4885
US-20190314515-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 FOLH1 1/4885TDP1 2364/4885CPB2 297/4885
US-20170114341-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING BIOREVERSIBLE AND NON-BIOREVERSIBLE GROUPS HNRNPC, RNASE1, NSUN3 FOLH1 1982/4885TDP1 495/4885CPB2 1167/4885
US-20170258932-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 FOLH1 1/4885TDP1 2364/4885CPB2 297/4885

“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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