SCHEMBL22367366

SCHEMBL22367366

Cc1cc(C(C(=O)O)C(C)C)sn1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
KDM4E B2RXH2 1/20 0.39
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
APAF1 O14727 1/20 0.33
POLB P06746 1/20 0.33
VHL P40337 1/20 0.32
ELOC Q15369 1/20 0.32
ELOB Q15370 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL768751 0.72
Hydrochloric Acid SCHEMBL10922590 0.68 DAO (0.44) LMNAAKR1C3AKR1C2
SCHEMBL5521073 0.67 ALOX5 (0.49) LMNAAKR1C3AKR1C2POLBALDH1A1
SCHEMBL19697101 0.66
Isopropylamine SCHEMBL9465349 0.66 KDM4E (0.41) LMNAKDM4EPOLBALDH1A1
SCHEMBL18551329 0.66 HCAR2 (0.48) KDM4EPOLBVHLELOCELOB
SCHEMBL12123794 0.64 CYP2D6 (0.38) AKR1C3AKR1C2ALDH1A1
SCHEMBL28329651 0.63 AKR1C3 (0.47) LMNAKDM4EAKR1C3AKR1C2ALDH1A1
SCHEMBL5510009 0.63 ALOX5 (0.49) LMNAKDM4EPOLBALDH1A1
SCHEMBL5515135 0.63 ALOX5 (0.49) LMNAKDM4EPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11242344-B2 (4-hydroxypyrrolidin-2-yl)-heterocyclic compounds and methods of use thereof GENENTECH, INC. (US) 2022-02-08 US disclosed
US-11242344-B2 (4-hydroxypyrrolidin-2-yl)-heterocyclic compounds and methods of use thereof GENENTECH, INC. (US) 2022-02-08 US disclosed
US-20210309660-A1 (4-HYDROXYPYRROLIDIN-2-YL)-HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH INC (US) 2021-10-07 US disclosed
US-20210309660-A1 (4-HYDROXYPYRROLIDIN-2-YL)-HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH INC (US) 2021-10-07 US disclosed
EP-3700901-A1 (4-HYDROXYPYRROLIDIN-2-YL)-HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF Genentech, Inc. (US) 2020-09-02 EP 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-20210309660-A1 (4-HYDROXYPYRROLIDIN-2-YL)-HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF VHL, MDM2, CUL2 LMNA 2919/4885KDM4E 731/4885AKR1C3 2454/4885
US-11242344-B2 (4-hydroxypyrrolidin-2-yl)-heterocyclic compounds and methods of use thereof VHL, MDM2, CUL2 LMNA 2919/4885KDM4E 731/4885AKR1C3 2454/4885

“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.