SCHEMBL16645332

SCHEMBL16645332

CCN1CCN(CC(=O)O)CCN(CC(=O)O)CC1

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.52
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4E B2RXH2 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 3/20 0.43
LMNA P02545 2/20 0.43
HSD11B1 P28845 2/20 0.43
S1PR1 P21453 1/20 0.42
MAPT P10636 1/20 0.42
GAA P10253 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
SCHEMBL15468170 1.00 HSD17B10 (0.52) HSD17B10MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL5517050 1.00 HSD17B10 (0.52) HSD17B10MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL126194 1.00 HSD17B10 (0.52) HSD17B10MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL21547377 1.00 HSD17B10 (0.52) HSD17B10MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL12344760 1.00 HSD17B10 (0.52) HSD17B10MEN1KMT2AKDM4ESMN1; SMN2
Bromide SCHEMBL2542868 0.98 HSD17B10 (0.50) HSD17B10MEN1KMT2AKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL1375642 0.98 HSD17B10 (0.50) HSD17B10MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL16645317 0.93 HSD17B10 (0.47) HSD17B10MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL29299530 0.91 HSD17B10 (0.45) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL20686921 0.91 HSD17B10 (0.45) HSD17B10MEN1KMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4455159-A1 GASTRIC INHIBITORY PEPTIDE RECEPTOR LIGANDS WITH BIO-DISTRIBUTION MODIFIER 3B Pharmaceuticals GmbH (DE) 2024-10-30 EP disclosed
WO-2022269532-A1 TRIAZINE DERIVATIVES FOR THE TREATMENT OF TUMOURS AND NEURODEGENERATIVE DISORDERS UNIVERSITA' DEGLI STUDI DI MILANO (IT) 2022-12-29 WO disclosed
WO-2022156793-A1 QUINOXALINE-BASED D-A-D NEAR-INFRARED TWO-REGION FLUORESCENT MOLECULE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院上海药物研究所 2022-07-28 WO disclosed
EP-3222617-B1 PSMA-TARGETING COMPOUNDS AND USES THEREOF UNIV JOHNS HOPKINS (US) 2022-07-06 EP disclosed
WO-2022002022-A1 RADIONUCLIDE LABEL AND USE THEREOF 北京拓界生物医药科技有限公司 2022-01-06 WO disclosed
US-10981866-B2 Chemical conjugates of Evans Blue derivatives and their use as radiotherapy and imaging agents THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2021-04-20 US disclosed
US-10758634-B2 Compounds, compositions and associated methods using zirconium-89 in immuno-positron emission tomography WAKE FOREST UNIVERSITY (US) 2020-09-01 US disclosed
US-10696631-B2 Chemical conjugates of evans blue derivatives and their use as radiotherapy and imaging agents THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2020-06-30 US disclosed
US-20190084931-A1 CHEMICAL CONJUGATES OF EVANS BLUE DERIVATIVES AND THEIR USE AS RADIOTHERAPY AND IMAGING AGENTS US HEALTH 2019-03-21 US disclosed
US-20190038785-A1 COMPOUNDS, COMPOSITIONS AND ASSOCIATED METHODS USING ZIRCONIUM-89 IN IMMUNO-POSITRON EMISSION TOMOGRAPHY WAKE FOREST UNIVERSITY 2019-02-07 US 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
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 (6 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-20190084931-A1 CHEMICAL CONJUGATES OF EVANS BLUE DERIVATIVES AND THEIR USE AS RADIOTHERAPY AND IMAGING AGENTS H1-4, VIP, H1-3 HSD17B10 3363/4885MEN1 65/4885KMT2A 3799/4885
US-10758634-B2 Compounds, compositions and associated methods using zirconium-89 in immuno-positron emission tomography PAICS, IKZF2, ZRANB2 HSD17B10 4812/4885MEN1 1146/4885KMT2A 677/4885
US-20190038785-A1 COMPOUNDS, COMPOSITIONS AND ASSOCIATED METHODS USING ZIRCONIUM-89 IN IMMUNO-POSITRON EMISSION TOMOGRAPHY PAICS, IKZF2, ZRANB2 HSD17B10 4812/4885MEN1 1146/4885KMT2A 677/4885
US-20150104387-A1 PSMA-TARGETING COMPOUNDS AND USES THEREOF FOLH1, KLK3, PSMA2 HSD17B10 2398/4885MEN1 190/4885KMT2A 2318/4885
US-10981866-B2 Chemical conjugates of Evans Blue derivatives and their use as radiotherapy and imaging agents RABL3, H1-4, SSTR3 HSD17B10 3981/4885MEN1 217/4885KMT2A 3229/4885
US-10696631-B2 Chemical conjugates of evans blue derivatives and their use as radiotherapy and imaging agents H1-4, VIP, H1-3 HSD17B10 3363/4885MEN1 65/4885KMT2A 3799/4885

“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.