SCHEMBL96209

SCHEMBL96209

COc1cc(C)ccc1C=O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.66
TSHR P16473 2/20 0.57
KDM4E B2RXH2 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
ERN1 O75460 2/20 0.56
ACHE P22303 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.54
NPC1 O15118 1/20 0.49
POLB P06746 1/20 0.49
RAB9A P51151 1/20 0.49
PRKDC P78527 1/20 0.47
HPGD P15428 3/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CYP3A4 P08684 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
TRIM24 O15164 1/20 0.44
TYR P14679 1/20 0.44
TRIM33 Q9UPN9 1/20 0.44

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
SCHEMBL29951947 1.00 ALDH1A1 (0.66) ALDH1A1TSHRKDM4ETDP1ERN1
SCHEMBL5734790 0.85 ALDH1A1 (0.58) ALDH1A1TSHRKDM4ETDP1ERN1
SCHEMBL419596 0.83 ALDH1A1 (0.57) ALDH1A1TSHRKDM4ETDP1ERN1
SCHEMBL29249202 0.83 ACHE (0.60) ALDH1A1TSHRKDM4ETDP1ERN1
SCHEMBL13807149 0.82 ACHE (0.50) ALDH1A1TSHRKDM4ETDP1ERN1
SCHEMBL17320187 0.82 ACHE (0.50) ALDH1A1TSHRKDM4ETDP1ERN1
SCHEMBL12257883 0.82 ALDH1A1 (0.44) ALDH1A1TSHRKDM4ETDP1ERN1
SCHEMBL27460529 0.82 ALDH1A1 (0.50) ALDH1A1TSHRKDM4ETDP1ERN1
SCHEMBL32670810 0.81 ALDH1A1 (0.68) ALDH1A1TSHRKDM4ETDP1ERN1
SCHEMBL11871188 0.81 ALDH1A1 (0.68) ALDH1A1TSHRKDM4ETDP1ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4707264-A2 COMPOUNDS AND THE USE THEREOF IN METATHESIS REACTIONS Verbio SE (DE) 2026-03-11 EP disclosed
EP-4122924-B1 COMPOUNDS AND THE USE THEREOF IN METATHESIS REACTIONS VERBIO SE (DE) 2025-11-19 EP disclosed
CN-118459478-B BRD4 protein targeted degradation agent and preparation method and application thereof 深圳大学 2024-10-29 CN disclosed
US-12065450-B2 Compounds and the use thereof in metathesis reactions VERBIO SE (DE) 2024-08-20 US disclosed
US-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT TAIHO PHARMACEUTICAL CO., LTD. (JP) 2024-07-18 US disclosed
CN-117800921-B Imidazolidine diketone HDAC inhibitor, preparation method and application 南京市鸿舜医药科技有限公司 2024-06-11 CN disclosed
CN-117800921-A Imidazolidine diketone HDAC inhibitor, preparation method and application 南京市鸿舜医药科技有限公司 2024-04-02 CN disclosed
CN-113286792-B N-chromen-4-one containing derivatives for the treatment and prevention of hepatitis b virus infection 豪夫迈·罗氏有限公司 2023-12-05 CN disclosed
US-11780814-B2 Small molecules for treating cancer, inhibiting chemokine activity and/or inducing cell death ALONBIO LTD. (IL) 2023-10-10 US disclosed
US-20230265087-A1 SMALL MOLECULE ACTIVATORS OF TIE-2 EyePoint, Inc. 2023-08-24 US disclosed
US-4999448-A ALKYLATION WITH PHENYLTHIOMETHYL LITHIUM COMPOUND, CYCLIZATION, INTERMEDIATES FOR HERBICIDES THE DOW CHEMICAL COMPANY (US) 1991-03-12 US disclosed
EP-0403026-A1 12-Substituted-12H-dibenzo(D,G)(1,3)dioxocin-6-carboxylic acids, herbicidal compositions, and a method of controlling undesirable vegetation DowElanco (US) 1990-12-19 EP disclosed
US-4938790-A Herbicidal 12-substituted 12H-dibenzo(D,G)(1,3)dioxocin-6-carboxylic acids THE DOW CHEMICAL COMPANY (US) 1990-07-03 US disclosed
US-4822805-A ANTIINFLAMMATORY AGENTS, CARDIOTONIC AGENTS, ANTIPLATELET AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-04-18 US disclosed
EP-0257897-A1 Imidazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-03-02 EP disclosed
US-4457810-A ANODIC OXIDATION OF DI-P-TOLYL ETHER IN PRESENCE OF METHANOL HOECHST AKTIENGESELLSCHAFT (DE) 1984-07-03 US disclosed
EP-0054698-B1 4,4'-DIPHENYL ETHER-DIALDEHYDE-BIS-DIMETHYL ACETAL, AND A METHOD FOR ITS PREPARATION HOECHST AKTIENGESELLSCHAFT (DE) 1984-06-20 EP disclosed
US-4444567-A ALKOXY BENZALDEHYDES, ALKOXY BENZOATES PHILLIPS PETROLEUM COMPANY (US) 1984-04-24 US disclosed
US-4405816-A INTERMEDIATES FOR POLYETHERS AND LIGHT SEN ITIVE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1983-09-20 US disclosed
EP-0054698-A1 4,4'-Diphenyl ether-dialdehyde-bis-dimethyl acetal, and a method for its preparation HOECHST AKTIENGESELLSCHAFT (DE) 1982-06-30 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 (4 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-12065450-B2 Compounds and the use thereof in metathesis reactions PRMT6, CYP2D6, POR ALDH1A1 1286/4885TSHR 1953/4885KDM4E 2310/4885
US-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT KRAS, NRAS, HRAS ALDH1A1 2871/4885TSHR 4424/4885KDM4E 3110/4885
US-20230265087-A1 SMALL MOLECULE ACTIVATORS OF TIE-2 TIE1, TEK, KDR ALDH1A1 3772/4885TSHR 2258/4885KDM4E 2036/4885
US-11780814-B2 Small molecules for treating cancer, inhibiting chemokine activity and/or inducing cell death CCL2, CXCR2, CCL5 ALDH1A1 1330/4885TSHR 2468/4885KDM4E 3394/4885

“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.