SCHEMBL21360123

SCHEMBL21360123

O=Cc1c(O)cc(O)c2c1CCC2

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.38
MAPT P10636 1/20 0.38
ERN1 O75460 4/20 0.35
USP2 O75604 1/20 0.33
MAOA P21397 1/20 0.32
KDM4E B2RXH2 1/20 0.30
PTGS2 P35354 1/20 0.30
RAB9A P51151 1/20 0.30
ALOX5 P09917 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
SCHEMBL21367494 0.80 ERN1 (0.53) CYP3A4MAPTERN1KDM4E
SCHEMBL30777445 0.80 ERN1 (0.53) CYP3A4MAPTERN1KDM4E
SCHEMBL21584111 0.73 ERN1 (0.36) CYP3A4MAPTERN1
SCHEMBL30777448 0.72 BCL2L1 (0.42) ERN1
SCHEMBL5367901 0.69 PIM1 (0.43) ERN1
SCHEMBL10609480 0.69 CYP3A4 (0.52) CYP3A4MAPTERN1USP2KDM4E
SCHEMBL1506612 0.68 BCL2L1 (0.47) ERN1
SCHEMBL12035880 0.67 TRIM24 (0.40) ERN1KDM4EPTGS2RAB9A
SCHEMBL21367505 0.66 ERN1 (0.42) CYP3A4MAPTERN1KDM4EALOX5
SCHEMBL31648926 0.66 CYP3A4 (0.48) CYP3A4MAPTERN1USP2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240246931-A1 COMPOUNDS AS PD1/PD-L1 INHIBITORS AND METHODS THEREOF Jubilant Prodel LLC (US) 2024-07-25 US disclosed
CN-117729921-A Compounds and methods as PD1/PD-L1 inhibitors 朱比兰特普罗德尔有限公司 2024-03-19 CN disclosed
EP-4326272-A1 COMPOUNDS AS PD1/PD-L1 INHIBITORS AND METHODS THEREOF Jubilant Prodel LLC (US) 2024-02-28 EP disclosed
CN-112105610-B Bicyclic compounds as inhibitors of PD1/PD-L1 interaction/activation 朱比连特普罗德尔有限责任公司 2024-01-26 CN disclosed
US-11529341-B2 Bicyclic compounds as inhibitors of PD1/PD-L1 interaction/activation Jubilant Prodel LLC 2022-12-20 US disclosed
US-11529341-B2 Bicyclic compounds as inhibitors of PD1/PD-L1 interaction/activation Jubilant Prodel LLC 2022-12-20 US disclosed
WO-2022224278-A1 COMPOUNDS AS PD1/PD-L1 INHIBITORS AND METHODS THEREOF Jubilant Prodel LLC (US) 2022-10-27 WO disclosed
WO-2022224278-A1 COMPOUNDS AS PD1/PD-L1 INHIBITORS AND METHODS THEREOF Jubilant Prodel LLC (US) 2022-10-27 WO disclosed
US-20210015810-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF PD1/PD-L1 INTERACTION/ACTIVATION Jubilant Prodel LLC 2021-01-21 US disclosed
US-20210015810-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF PD1/PD-L1 INTERACTION/ACTIVATION Jubilant Prodel LLC 2021-01-21 US disclosed
EP-3765453-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF PD1/PD-L1 INTERACTION/ACTIVATION Jubilant Prodel LLC (US) 2021-01-20 EP disclosed
CN-112105610-A Bicyclic compounds as inhibitors of PD1/PD-L1 interaction/activation 朱比连特普罗德尔有限责任公司 2020-12-18 CN disclosed
WO-2019175897-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF PD1/PD-L1 INTERACTION/ACTIVATION JUBILANT BIOSYS LIMITED (IN) 2019-09-19 WO disclosed
WO-2019175897-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF PD1/PD-L1 INTERACTION/ACTIVATION JUBILANT BIOSYS LIMITED (IN) 2019-09-19 WO 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-20210015810-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF PD1/PD-L1 INTERACTION/ACTIVATION CD274, PDCD1, PDCD1LG2 CYP3A4 89/4885MAPT 147/4885ERN1 2506/4885
US-20240246931-A1 COMPOUNDS AS PD1/PD-L1 INHIBITORS AND METHODS THEREOF CD274, PDCD1, PDCD1LG2 CYP3A4 1911/4885MAPT 1643/4885ERN1 1997/4885
US-11529341-B2 Bicyclic compounds as inhibitors of PD1/PD-L1 interaction/activation CD274, PDCD1, PDCD1LG2 CYP3A4 89/4885MAPT 147/4885ERN1 2506/4885

“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.