SCHEMBL4474802

SCHEMBL4474802

CC(=O)Oc1ccc2c(c1)C(=O)OC2=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.51
CA9 Q16790 2/20 0.51
ALDH1A1 P00352 3/20 0.51
MAPT P10636 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
GAPDH P04406 2/20 0.49
NPC1 O15118 3/20 0.49
POLB P06746 2/20 0.49
KDM4E B2RXH2 4/20 0.49
GLA P06280 3/20 0.49
GAA P10253 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
LMNA P02545 3/20 0.49
CYP3A4 P08684 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
USP2 O75604 2/20 0.48
HTT P42858 1/20 0.48
FLT3 P36888 1/20 0.47
BACE1 P56817 1/20 0.47

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
SCHEMBL10416103 0.91 GAPDH (0.49) CA12CA9ALDH1A1MAPTSMN1; SMN2
SCHEMBL12337780 0.85 ALOX15 (0.43) CA12CA9ALDH1A1MAPTSMN1; SMN2
SCHEMBL19996956 0.85 ELANE (0.49) CA12CA9ALDH1A1MAPTSMN1; SMN2
SCHEMBL17717380 0.83 ELANE (0.49) CA12CA9ALDH1A1MAPTSMN1; SMN2
SCHEMBL3320871 0.82 ALOX15 (0.40) CA12CA9ALDH1A1MAPTSMN1; SMN2
SCHEMBL28836885 0.81 CA2 (0.40) CA12CA9ALDH1A1MAPTSMN1; SMN2
SCHEMBL4204276 0.81 KMT2A (0.51) CA12CA9ALDH1A1MAPTPOLB
SCHEMBL8968025 0.81 KMT2A (0.48) CA12CA9ALDH1A1MAPTPOLB
SCHEMBL29426396 0.81 KMT2A (0.51) CA12CA9ALDH1A1MAPTPOLB
SCHEMBL11908094 0.80 PIK3C3 (0.41) CA12CA9ALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107653034-A High-efficiency energy-saving nano carbon molecules based lubricating oil and preparation method thereof 魏衡 2018-02-02 CN claimed
CN-120202243-A Thermosetting resin composition, cured film, substrate, and electronic component 捷恩智株式会社 2025-06-24 CN disclosed
CN-115819384-B Method for preparing phthalic anhydride and derivatives thereof by catalyzing and oxidizing aromatic ketone by V-N-C material 大连理工大学 2024-04-26 CN disclosed
CN-109810041-B Halogenated allylamine SSAO/VAP-1 inhibitor and application thereof 药捷安康(南京)科技股份有限公司 2023-08-15 CN disclosed
US-11649233-B2 Halo-allylamine SSAO/VAP-1 inhibitor and use thereof NANJING TRANSTHERA BIOSCIENCES CO., LTD. (CN) 2023-05-16 US disclosed
US-11649233-B2 Halo-allylamine SSAO/VAP-1 inhibitor and use thereof NANJING TRANSTHERA BIOSCIENCES CO., LTD. (CN) 2023-05-16 US disclosed
US-11649233-B2 Halo-allylamine SSAO/VAP-1 inhibitor and use thereof NANJING TRANSTHERA BIOSCIENCES CO., LTD. (CN) 2023-05-16 US disclosed
CN-115819384-A Method for preparing phthalic anhydride and derivatives thereof by catalytic oxidation of aromatic ketone with V-N-C material 大连理工大学 2023-03-21 CN disclosed
US-20220387362-A1 COMPOSITIONS COMPRISING A DHODH INHIBITOR FOR THE TREATMENT OF ACUTE MYELOID LEUKEMIA RHIZEN PHARMACEUTICALS AG (CH) 2022-12-08 US disclosed
EP-4048251-A1 COMPOSITIONS COMPRISING A DHODH INHIBITOR FOR THE TREATMENT OF ACUTE MYELOID LEUKEMIA Rhizen Pharmaceuticals AG (CH) 2022-08-31 EP disclosed
WO-1995030647-A1 CCK AND GASTRIN RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 1995-11-16 WO disclosed
US-5446124-A A copolymer of polylactones and polythioesters; a modifying agent for thermoplastic or thermosetting resins enhancing performance SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-08-29 US disclosed
EP-0511385-B1 THERMOPLASTIC GRAFT COPOLYMER AND PRODUCTION THEREOF SUMITOMO CHEMICAL CO (JP) 1995-06-14 EP disclosed
US-5376730-A Grafting an aromatic carboxy oligomer to an addition polymer; heat resistant hoses, seals SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-12-27 US disclosed
EP-0594845-A1 AROMATIC OLIGOMER AND PRODUCTION THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-05-04 EP disclosed
EP-0567313-A1 Thermoplastic graft copolymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-10-27 EP disclosed
EP-0511385-A1 THERMOPLASTIC GRAFT COPOLYMER AND PRODUCTION THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-11-04 EP disclosed
US-5153335-A Reacting halophthalic anhydride and alkali metal salt with acid or acid derivative catalyst OCCIDENTAL CHEMICAL CORPORATION (US) 1992-10-06 US disclosed
EP-0460687-A2 Process for the preparation of oxydiphthalic anhydride and acyloxyphthalic anhydrides OCCIDENTAL CHEMICAL CORPORATION (US) 1991-12-11 EP disclosed
US-4952721-A AIR OXIDATION WITH HEAVY METAL CATALYSTS AMOCO CORPORATION (US) 1990-08-28 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 (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-11649233-B2 Halo-allylamine SSAO/VAP-1 inhibitor and use thereof VAPB, VAPA, ADRA1D CA12 4714/4885CA9 4213/4885ALDH1A1 326/4885
US-20220387362-A1 COMPOSITIONS COMPRISING A DHODH INHIBITOR FOR THE TREATMENT OF ACUTE MYELOID LEUKEMIA DHODH, FLT3, IDH3A CA12 3984/4885CA9 2456/4885ALDH1A1 176/4885

“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.