SCHEMBL298629

SCHEMBL298629

O=C(O)c1ccc(-c2cc[c]cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.58
BAD Q92934 1/20 0.58
TSHR P16473 2/20 0.57
TP53 P04637 1/20 0.57
RXRA P19793 6/20 0.52
RXRB P28702 5/20 0.52
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
CA14 Q9ULX7 2/20 0.50
SRD5A2 P31213 2/20 0.50
HSD17B10 Q99714 2/20 0.48
EGFR P00533 1/20 0.48
CA3 P07451 1/20 0.48
TYR P14679 1/20 0.48
DRD1 P21728 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48

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
SCHEMBL28631597 0.98 BCL2L1 (0.56) BCL2L1BADTSHRTP53RXRA
SCHEMBL28633237 0.98 BCL2L1 (0.56) BCL2L1BADTSHRTP53RXRA
SCHEMBL28987693 0.96 BCL2L1 (0.54) BCL2L1BADTSHRTP53RXRA
Water SCHEMBL22788424 0.87 TSHR (0.75) BCL2L1BADTSHRTP53RXRA
Water SCHEMBL8605516 0.87 TSHR (0.75) BCL2L1BADTSHRTP53RXRA
SCHEMBL8070391 0.85 TSHR (0.61) BCL2L1BADTSHRTP53CA12
SCHEMBL20583 0.85
Water SCHEMBL27988849 0.85 TSHR (0.71) BCL2L1BADTSHRTP53RXRA
SCHEMBL69873 0.84 TSHR (0.80) BCL2L1BADTSHRTP53RXRA
SCHEMBL14018385 0.84 TSHR (0.80) BCL2L1BADTSHRTP53RXRA

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 68 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113237928-B Electrochemical luminescence sensor for detecting hepatitis B virus DNA and preparation and application thereof 重庆医科大学 2023-02-17 CN claimed
CN-113237928-A Electrochemical luminescence sensor for detecting hepatitis B virus DNA and preparation and application thereof 重庆医科大学 2021-08-10 CN claimed
EP-0770079-B1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2003-02-12 EP claimed
US-20020107251-A1 Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-08-08 US claimed
US-6426345-B1 PHOSPHODIESTERASE INHIBITORS; ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-07-30 US claimed
CN-1157617-A Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1997-08-20 CN claimed
EP-0770079-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-02 EP claimed
WO-1996001825-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-01-25 WO claimed
CN-113237928-B Electrochemical luminescence sensor for detecting hepatitis B virus DNA and preparation and application thereof 重庆医科大学 2023-02-17 CN disclosed
CN-114031788-B Microporous zinc coordination polymer for propyne propylene separation and preparation method thereof 北京工业大学 2022-06-14 CN disclosed
CN-113603897-B Preparation of zinc-based metal organic framework material and selective adsorption application thereof 北京工业大学 2022-06-07 CN disclosed
CN-114031788-A Microporous zinc coordination polymer for propyne propylene separation and preparation method thereof 北京工业大学 2022-02-11 CN disclosed
CN-113603897-A Preparation of zinc-based metal organic framework material and selective adsorption application thereof 北京工业大学 2021-11-05 CN disclosed
CN-113237928-A Electrochemical luminescence sensor for detecting hepatitis B virus DNA and preparation and application thereof 重庆医科大学 2021-08-10 CN disclosed
CN-1051548-C Heterobicyclic derivatives, pharmaceutical compositions containing them, process for preparing them and their use FUJISAWA PHARMACEUTICAL CO (JP) 2000-04-19 CN disclosed
CN-1157617-A Heterobicyclic derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1997-08-20 CN disclosed
EP-0770079-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-02 EP disclosed
WO-1996001825-A1 HETEROBICYCLIC DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-01-25 WO disclosed
US-4959387-A ISOBENZOFURAN COMPOUNDS SYNTEX (U.S.A.) INC. (US) 1990-09-25 US disclosed
US-4725622-A Mycophenolic acid derivatives in the treatment of rheumatoid arthritis SYNTEX (U.S.A.) INC. (US) 1988-02-16 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 (1 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-20020107251-A1 Heterobicyclic derivatives ARSA, ARRB1, SULT2A1 BCL2L1 2603/4885BAD 3260/4885TSHR 916/4885

“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.