SCHEMBL3366384

SCHEMBL3366384

c1ccc2c(c1)COCCO2

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.62
LMNA P02545 3/20 0.62
CRHBP P24387 2/20 0.62
CRHR2 Q13324 2/20 0.62
HTT P42858 2/20 0.62
ITGB2 P05107 1/20 0.56
ICAM1 P05362 1/20 0.56
ITGAL P20701 1/20 0.56
GAA P10253 2/20 0.46
OXTR P30559 1/20 0.42
KDM4E B2RXH2 2/20 0.40
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
MAPT P10636 3/20 0.36
BLM P54132 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NISCH Q9Y2I1 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL3705883 0.90 SMN1; SMN2 (0.57) SMN1; SMN2LMNACRHBPCRHR2HTT
SCHEMBL4424800 0.89 SMN1; SMN2 (0.74) SMN1; SMN2LMNACRHBPCRHR2HTT
SCHEMBL7567158 0.89 SMN1; SMN2 (0.74) SMN1; SMN2LMNACRHBPCRHR2HTT
SCHEMBL7565783 0.89 SMN1; SMN2 (0.74) SMN1; SMN2LMNACRHBPCRHR2HTT
SCHEMBL19680565 0.86 LMNA (0.63) SMN1; SMN2LMNACRHBPCRHR2HTT
SCHEMBL10861876 0.84 SMN1; SMN2 (0.48) SMN1; SMN2LMNACRHBPCRHR2HTT
Dioxane SCHEMBL27667743 0.83 SMN1; SMN2 (0.52) SMN1; SMN2LMNACRHBPCRHR2HTT
SCHEMBL35655 0.82 SMN1; SMN2 (0.63) SMN1; SMN2LMNACRHBPCRHR2HTT
SCHEMBL10170816 0.80 OXTR (0.52) SMN1; SMN2LMNACRHBPCRHR2HTT
SCHEMBL346944 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110234641-B Germination promoter 先正达参股股份有限公司 2022-10-14 CN disclosed
US-11434472-B2 Agent for removing undifferentiated iPS cells Sumitomo Pharma Co., Ltd. (JP) 2022-09-06 US disclosed
CN-109072178-B Haploid inducer compositions and methods of use thereof 先正达参股股份有限公司 2022-08-02 CN disclosed
US-20220127281-A1 HETEROARYL COMPOUNDS THAT INHIBIT G12C MUTANT RAS PROTEINS ASTRAZENECA UK LIMITED (GB) 2022-04-28 US disclosed
EP-3450433-B1 PURINE DERIVATIVES AS TLR7 INHIBITORS FOR TREATING E.G. SYSTEMIC LUPUS ERYTHEMATOSUS SUMITOMO DAINIPPON PHARMA CO LTD (JP) 2021-08-18 EP disclosed
CN-109414019-B Plant growth regulator compounds 先正达参股股份有限公司 2021-04-30 CN disclosed
CN-107207440-B 2-oxo-3, 4-dihydroquinoline compounds as plant growth regulators 先正达参股股份有限公司 2020-11-10 CN disclosed
US-20200268728-A1 DRUG TARGETING CANCER STEM CELL SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-08-27 US disclosed
US-10703755-B2 Substituted purine derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-07-07 US disclosed
US-20200109153-A1 HETEROARYL COMPOUNDS THAT INHIBIT G12C MUTANT RAS PROTEINS ASTRAZENECA AB (SE) 2020-04-09 US disclosed
US-20040053826-A1 Uses of polypeptides TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-18 US disclosed
US-20030207863-A1 Preventives and remedies for central nervous system diseases TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-11-06 US disclosed
EP-1331010-A1 PREVENTIVES AND REMEDIES FOR CENTRAL NERVOUS SYSTEM DISEASES Takeda Chemical Industries, Ltd. (JP) 2003-07-30 EP disclosed
EP-1310490-A1 GPR14 ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2003-05-14 EP disclosed
EP-1308513-A1 USE OF POLYPEPTIDE Takeda Chemical Industries, Ltd. (JP) 2003-05-07 EP disclosed
US-6534496-B1 Prophylactic and/or therapeutic drug for obesity and obesity associated diseasestor diabetes with a reduced risk for central side effects and high universality in usage. Another object of the a lipolytic agent, or a prophylactic and/or TAKEDA CHEMICAL INDUSTRIES, INC. (JP) 2003-03-18 US disclosed
US-20020177593-A1 Agents and crystals for improving excretory potency of urinary bladder TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2002-11-28 US disclosed
US-6319916-B1 CHOLINESTERASE INHIBITOR FOR SENILE DEMENTIA AND ALZHEIMER'S TREATMENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-11-20 US disclosed
EP-1118322-A1 DRUGS FOR IMPROVING VESICAL EXCRETORY STRENGTH Takeda Chemical Industries, Ltd. (JP) 2001-07-25 EP disclosed
EP-0567090-A2 Benzoxazepine derivatives as cholinesterase inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-27 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 (8 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-20200109153-A1 HETEROARYL COMPOUNDS THAT INHIBIT G12C MUTANT RAS PROTEINS KRAS, NRAS, HRAS SMN1; SMN2 1691/4885LMNA 2364/4885CRHBP 3797/4885
US-20220127281-A1 HETEROARYL COMPOUNDS THAT INHIBIT G12C MUTANT RAS PROTEINS KRAS, NRAS, HRAS SMN1; SMN2 1617/4885LMNA 2320/4885CRHBP 3799/4885
US-20020177593-A1 Agents and crystals for improving excretory potency of urinary bladder ACHE, BPHL, BCHE SMN1; SMN2 2689/4885LMNA 3299/4885CRHBP 4339/4885
US-11434472-B2 Agent for removing undifferentiated iPS cells SALL4, NR4A2, NES SMN1; SMN2 2230/4885LMNA 2989/4885CRHBP 3596/4885
US-20040053826-A1 Uses of polypeptides NPSR1, SCTR, GRPR SMN1; SMN2 3147/4885LMNA 3551/4885CRHBP 107/4885
US-20030207863-A1 Preventives and remedies for central nervous system diseases UTS2R, PRSS12, CTSA SMN1; SMN2 90/4885LMNA 1884/4885CRHBP 667/4885
US-20200268728-A1 DRUG TARGETING CANCER STEM CELL NR5A1, NR3C1, NR3C2 SMN1; SMN2 3102/4885LMNA 3942/4885CRHBP 3581/4885
US-10703755-B2 Substituted purine derivative TLR7, TLR9, TLR1 SMN1; SMN2 967/4885LMNA 1693/4885CRHBP 3515/4885

“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.