SCHEMBL22367416

SCHEMBL22367416

COCCOc1cc2ncnc(Nc3cccc(Br)c3)c2cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 4/20 1.00
EGFR P00533 10/20 0.83
KDR P35968 8/20 0.83
ERBB2 P04626 4/20 0.83
GAK O14976 2/20 0.83
ABL1 P00519 2/20 0.83
CYP3A4 P08684 2/20 0.83
SRC P12931 2/20 0.83
MKNK1 Q9BUB5 2/20 0.83
ABCG2 Q9UNQ0 2/20 0.83
KDM4E B2RXH2 1/20 0.83
MAPK13 O15264 1/20 0.83
CYP1A2 P05177 1/20 0.83
CDK1 P06493 1/20 0.83
CYP2D6 P10635 1/20 0.83
MAPT P10636 1/20 0.83
CYP2C9 P11712 1/20 0.83
TSHR P16473 1/20 0.83
MAPK1 P28482 1/20 0.83
EPHB2 P29323 1/20 0.83

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
SCHEMBL8349430 0.93 EGFR (0.91) FBP1EGFRKDRERBB2GAK
SCHEMBL4232360 0.92 FBP1 (0.84) FBP1EGFRKDRERBB2GAK
SCHEMBL29444884 0.91 EGFR (1.00) FBP1EGFRKDRERBB2GAK
SCHEMBL9423 0.91 EGFR (1.00) FBP1EGFRKDRERBB2GAK
SCHEMBL30363011 0.91 EGFR (1.00) FBP1EGFRKDRERBB2GAK
SCHEMBL5742396 0.91 EGFR (0.86) FBP1EGFRKDRERBB2GAK
SCHEMBL28641557 0.91 FBP1 (0.83) FBP1EGFRKDRERBB2GAK
Hydrochloric Acid SCHEMBL29369196 0.90 EGFR (1.00) FBP1EGFRKDRERBB2GAK
Hydrochloric Acid SCHEMBL30362813 0.90 EGFR (1.00) FBP1EGFRKDRERBB2GAK
Hydrochloric Acid SCHEMBL93918 0.90 EGFR (1.00) FBP1EGFRKDRERBB2GAK

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 FBP1 3252/4885EGFR 2005/4885KDR 327/4885
US-11242344-B2 (4-hydroxypyrrolidin-2-yl)-heterocyclic compounds and methods of use thereof VHL, MDM2, CUL2 FBP1 3252/4885EGFR 2005/4885KDR 327/4885

“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.