SCHEMBL19079019

SCHEMBL19079019

CC(C)(C)NC(=O)CCc1ccc(O)c(CN(CCN(CC(=O)O)Cc2cc(CCC(=O)O)ccc2O)CC(=O)O)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.54
CA1 P00915 12/20 0.40
CA2 P00918 12/20 0.40
FFAR4 Q5NUL3 1/20 0.38
CA12 O43570 4/20 0.38
CA9 Q16790 4/20 0.38
CA4 P22748 5/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
MEN1 O00255 1/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 1/20 0.35
PLA2G4A P47712 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
SCHEMBL18811743 0.87 FOLH1 (0.56) FOLH1CA1CA2FFAR4CA12
SCHEMBL18412143 0.87 FOLH1 (0.47) FOLH1CA1CA2CA12CA9
SCHEMBL1404313 0.87 FOLH1 (0.56) FOLH1CA1CA2FFAR4CA12
SCHEMBL18811948 0.85 FOLH1 (0.61) FOLH1CA1CA2CA12CA9
SCHEMBL25797889 0.85 FOLH1 (0.49) FOLH1CA1CA2FFAR4CA12
SCHEMBL18811749 0.84 FOLH1 (0.58) FOLH1CA1CA2CA12CA9
SCHEMBL23940424 0.84 FOLH1 (0.49) FOLH1FFAR4RXRARXRBRXRG
SCHEMBL25741233 0.83 FOLH1 (0.52) FOLH1CA1CA2FFAR4CA12
SCHEMBL27303602 0.83 FOLH1 (0.52) FOLH1CA1CA2FFAR4CA12
SCHEMBL23863936 0.83 FOLH1 (0.62) FOLH1CA1CA2CA12CA9

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-10688200-B2 Urea-based prostate specific membrane antigen (PSMA) inhibitors for imaging and therapy FIVE ELEVEN PHARMA INC. (US) 2020-06-23 US disclosed
US-20170189568-A1 UREA-BASED PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITORS FOR IMAGING AND THERAPY FIVE ELEVEN PHARMA INC. 2017-07-06 US disclosed
US-20170189568-A1 UREA-BASED PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITORS FOR IMAGING AND THERAPY FIVE ELEVEN PHARMA INC. 2017-07-06 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-20170189568-A1 UREA-BASED PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITORS FOR IMAGING AND THERAPY KLK3, FOLH1, UTS2R FOLH1 2/4885CA1 645/4885CA2 427/4885
US-10688200-B2 Urea-based prostate specific membrane antigen (PSMA) inhibitors for imaging and therapy KLK3, FOLH1, UTS2R FOLH1 2/4885CA1 645/4885CA2 427/4885

“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.