SCHEMBL16645337

SCHEMBL16645337

Cc1ccc(CC2CN(CC(=O)O)CCN(CC(=O)O)CCN2CC(=O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
FOLH1 Q04609 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.42
SLC6A9 P48067 1/20 0.42
ALDH1A1 P00352 3/20 0.41
HTT P42858 1/20 0.40
S1PR1 P21453 2/20 0.40
S1PR5 Q9H228 1/20 0.40
HPGD P15428 1/20 0.40
DPP4 P27487 1/20 0.40
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL19447720 1.00 L3MBTL1 (0.45) L3MBTL1FOLH1MEN1KMT2ALMNA
SCHEMBL16645333 1.00 L3MBTL1 (0.45) L3MBTL1FOLH1MEN1KMT2ALMNA
SCHEMBL13013979 0.92 ALDH1A1 (0.44) L3MBTL1FOLH1MEN1KMT2ALMNA
SCHEMBL18807566 0.91 HSD17B10 (0.44) L3MBTL1FOLH1MEN1KMT2ALMNA
SCHEMBL15468169 0.90 MEN1 (0.47) L3MBTL1FOLH1MEN1KMT2ALMNA
SCHEMBL13013975 0.90 ALDH1A1 (0.47) L3MBTL1FOLH1MEN1KMT2ALMNA
SCHEMBL19605901 0.90 FOLH1 (0.45) FOLH1MEN1KMT2ASLC6A9S1PR1
SCHEMBL10060136 0.90 FOLH1 (0.45) FOLH1MEN1KMT2ASLC6A9S1PR1
SCHEMBL13013980 0.88 OPRM1 (0.40) L3MBTL1FOLH1MEN1KMT2ALMNA
SCHEMBL9032439 0.88 FOLH1 (0.45) FOLH1ALDH1A1S1PR1DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF PURDUE RESEARCH FOUNDATION 2024-07-18 US disclosed
EP-3222617-B1 PSMA-TARGETING COMPOUNDS AND USES THEREOF UNIV JOHNS HOPKINS (US) 2022-07-06 EP disclosed
WO-2017197251-A1 NUCLEAR IMAGING AND RADIOTHERAPEUTICS AGENTS TARGETING CARBONIC ANHYDRASE IX AND USES THEREOF THE JOHNS HOPKINS UNIVERSITY (US) 2017-11-16 WO disclosed
US-9776977-B2 PSMA-targeting compounds and uses thereof THE JOHNS HOPKINS UNIVERSITY (US) 2017-10-03 US disclosed
EP-3222617-A1 PSMA-TARGETING COMPOUNDS AND USES THEREOF The Johns Hopkins University (US) 2017-09-27 EP disclosed
US-20170128572-A1 LONG-LIVED GADOLINIUM BASED TUMOR TARGETED IMAGING AND THERAPY AGENTS WISCONSIN ALUMNI RESEARCH FOUNDATION 2017-05-11 US disclosed
EP-2408755-B1 Urea-based peptide compounds useful for detecting inter alia prostate cancer UNIV JOHNS HOPKINS (US) 2017-05-03 EP disclosed
US-9056841-B2 PSMA-targeting compounds and uses thereof THE JOHNS HOPKINS UNIVERSITY (US) 2015-06-16 US disclosed
US-20150104387-A1 PSMA-TARGETING COMPOUNDS AND USES THEREOF THE JOHNS HOPKINS UNIVERSITY (US) 2015-04-16 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 (3 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-20170128572-A1 LONG-LIVED GADOLINIUM BASED TUMOR TARGETED IMAGING AND THERAPY AGENTS H1-3, H1-2, H1-4 L3MBTL1 797/4885FOLH1 522/4885MEN1 529/4885
US-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF FAP, FIBP, FGFR1 L3MBTL1 3697/4885FOLH1 81/4885MEN1 2971/4885
US-20150104387-A1 PSMA-TARGETING COMPOUNDS AND USES THEREOF FOLH1, KLK3, PSMA2 L3MBTL1 2898/4885FOLH1 1/4885MEN1 190/4885

“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.