SCHEMBL20764288

SCHEMBL20764288

COC(=O)c1ccc(Oc2ccc(C=O)cn2)cn1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.58
ALDH1A1 P00352 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MAPK1 P28482 1/20 0.47
POLB P06746 1/20 0.44
LMNA P02545 1/20 0.44
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
GAA P10253 1/20 0.41
LIPE Q05469 1/20 0.40
P2RX3 P56373 3/20 0.40
ACACB O00763 5/20 0.39
ACACA Q13085 2/20 0.39

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
SCHEMBL516396 0.86 MAPK1 (0.61) KDM4EALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL4596521 0.84 KDM4E (0.65) KDM4EALDH1A1L3MBTL1POLBLMNA
SCHEMBL22529696 0.80 MAPK1 (0.54) KDM4EALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL30827080 0.80 MAPK1 (0.54) KDM4EALDH1A1L3MBTL1MAPK1LMNA
SCHEMBL8016820 0.77 KDM4E (0.77) KDM4EALDH1A1L3MBTL1POLBLMNA
SCHEMBL17869220 0.77 MAPT (0.51) KDM4EALDH1A1L3MBTL1MAPK1POLB
SCHEMBL32668910 0.77 MAPT (0.51) KDM4EALDH1A1L3MBTL1MAPK1POLB
SCHEMBL31621360 0.76 ALDH1A1 (0.81) KDM4EALDH1A1L3MBTL1POLBLMNA
SCHEMBL4597702 0.76 KDM4E (0.62) KDM4EALDH1A1L3MBTL1POLBLMNA
SCHEMBL30879467 0.75 KDM4E (0.72) KDM4EALDH1A1L3MBTL1POLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10913741-B2 Toll-like receptor 7 (TLR7) agonists having heteroatom-linked aromatic moieties, conjugates thereof, and methods and uses therefor BRISTOL-MYERS SQUIBB COMPANY (US) 2021-02-09 US disclosed
US-20200392137-A1 TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS HAVING HETEROATOM-LINKED AROMATIC MOIETIES, CONJUGATES THEREOF, AND METHODS AND USES THEREFOR BRISTOL-MYERS SQUIBB COMPANY 2020-12-17 US disclosed
US-10793569-B2 Toll-like receptor 7 (TLR7) agonists having heteroatom-linked aromatic moieties, conjugates thereof, and methods and uses therefor BRISTOL-MYERS SQUIBB COMPANY (US) 2020-10-06 US disclosed
US-20200255429-A1 TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS HAVING HETEROATOM-LINKED AROMATIC MOIETIES, CONJUGATES THEREOF, AND METHODS AND USES THEREFOR BRISTOL-MYERS SQUIBB COMPANY 2020-08-13 US disclosed
US-10689382-B2 Toll-like receptor 7 (TLR7) agonists having heteroatom-linked aromatic moieties, conjugates thereof, and methods and uses therefor BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-23 US disclosed
US-10508115-B2 Toll-like receptor 7 (TLR7) agonists having heteroatom-linked aromatic moieties, conjugates thereof, and methods and uses therefor BRISTOL-MYERS SQUIBB COMPANY (US) 2019-12-17 US disclosed
US-20190055247-A1 TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS HAVING HETEROATOM-LINKED AROMATIC MOIETIES, CONJUGATES THEREOF, AND METHODS AND USES THEREFOR BRISTOL-MYERS SQUIBB COMPANY 2019-02-21 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 (7 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-10508115-B2 Toll-like receptor 7 (TLR7) agonists having heteroatom-linked aromatic moieties, conjugates thereof, and methods and uses therefor TLR7, TLR1, TLR8 KDM4E 3378/4885ALDH1A1 2375/4885L3MBTL1 2318/4885
US-20200255429-A1 TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS HAVING HETEROATOM-LINKED AROMATIC MOIETIES, CONJUGATES THEREOF, AND METHODS AND USES THEREFOR TLR7, TLR1, TLR8 KDM4E 3378/4885ALDH1A1 2375/4885L3MBTL1 2318/4885
US-10793569-B2 Toll-like receptor 7 (TLR7) agonists having heteroatom-linked aromatic moieties, conjugates thereof, and methods and uses therefor TLR7, TLR1, TLR8 KDM4E 3378/4885ALDH1A1 2375/4885L3MBTL1 2318/4885
US-10913741-B2 Toll-like receptor 7 (TLR7) agonists having heteroatom-linked aromatic moieties, conjugates thereof, and methods and uses therefor TLR7, TLR1, TLR8 KDM4E 3265/4885ALDH1A1 2345/4885L3MBTL1 2430/4885
US-20190055247-A1 TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS HAVING HETEROATOM-LINKED AROMATIC MOIETIES, CONJUGATES THEREOF, AND METHODS AND USES THEREFOR TLR7, TLR1, TLR8 KDM4E 3378/4885ALDH1A1 2375/4885L3MBTL1 2318/4885
US-20200392137-A1 TOLL-LIKE RECEPTOR 7 (TLR7) AGONISTS HAVING HETEROATOM-LINKED AROMATIC MOIETIES, CONJUGATES THEREOF, AND METHODS AND USES THEREFOR TLR7, TLR1, TLR8 KDM4E 3378/4885ALDH1A1 2375/4885L3MBTL1 2318/4885
US-10689382-B2 Toll-like receptor 7 (TLR7) agonists having heteroatom-linked aromatic moieties, conjugates thereof, and methods and uses therefor TLR7, TLR1, TLR8 KDM4E 3378/4885ALDH1A1 2375/4885L3MBTL1 2318/4885

“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.