SCHEMBL22367354

SCHEMBL22367354

Cc1cc(CC(=O)O)sn1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AGBL2 Q5U5Z8 2/20 0.36
MAPT P10636 3/20 0.36
LMNA P02545 1/20 0.35
GABRR1 P24046 1/20 0.35
ALOX15 P16050 2/20 0.35
POLB P06746 2/20 0.35
HCAR2 Q8TDS4 1/20 0.34
RPS6KB2 Q9UBS0 1/20 0.34
KDM4E B2RXH2 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 2/20 0.33
HTT P42858 1/20 0.33
TSHR P16473 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SRC P12931 1/20 0.33

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
SCHEMBL27846156 0.78 POLB (0.36) MAPTLMNAPOLBRPS6KB2KDM4E
SCHEMBL3286549 0.74
SCHEMBL4665966 0.72 NPSR1 (0.44) MAPTALOX15POLBKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL9528592 0.71 DAO (0.42) MAPTALOX15HCAR2KDM4ESMN1; SMN2
SCHEMBL1527752 0.68
SCHEMBL23174821 0.68 GABRA5 (0.39) AGBL2MAPTLMNAGABRR1ALOX15
SCHEMBL17548461 0.67
SCHEMBL20320474 0.67 NOS3 (0.33) POLBKDM4EHPGDL3MBTL1
Hydrochloric Acid SCHEMBL1375734 0.67 VHL (0.58) MAPTPOLBHCAR2KDM4ESMN1; SMN2
SCHEMBL22367369 0.65

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
WO-2022135442-A1 CDK2 INHIBITOR AND PREPARATION METHOD THEREFOR 上海拓界生物医药科技有限公司 2022-06-30 WO disclosed
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 AGBL2 338/4885MAPT 3615/4885LMNA 2919/4885
US-11242344-B2 (4-hydroxypyrrolidin-2-yl)-heterocyclic compounds and methods of use thereof VHL, MDM2, CUL2 AGBL2 338/4885MAPT 3615/4885LMNA 2919/4885

“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.