SCHEMBL95420

SCHEMBL95420

[CH2]c1ccc(NC(C)=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.67
L3MBTL1 Q9Y468 3/20 0.67
HTT P42858 1/20 0.67
KMT2A Q03164 6/20 0.64
MEN1 O00255 4/20 0.64
ALDH1A1 P00352 3/20 0.64
MAPT P10636 3/20 0.64
CA12 O43570 2/20 0.64
CA1 P00915 2/20 0.64
CA2 P00918 2/20 0.64
CA9 Q16790 2/20 0.64
TDP1 Q9NUW8 1/20 0.64
BRD4 O60885 1/20 0.64
NR1I2 O75469 1/20 0.64
MB P02144 1/20 0.64
CYP1A1 P04798 1/20 0.64
CA3 P07451 1/20 0.64
CYP3A4 P08684 1/20 0.64
RARG P13631 1/20 0.64
TSHR P16473 1/20 0.64

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
SCHEMBL5612835 0.88 KMT2A (0.61) SMN1; SMN2L3MBTL1HTTKMT2AMEN1
SCHEMBL94356 0.88 CACNA1B (0.71) SMN1; SMN2L3MBTL1HTTKMT2AMEN1
SCHEMBL861674 0.87 SMN1; SMN2 (0.84) SMN1; SMN2L3MBTL1HTTKMT2AMEN1
SCHEMBL97361 0.82 KMT2A (0.68) SMN1; SMN2L3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL839533 0.82 SMN1; SMN2 (0.61) SMN1; SMN2L3MBTL1HTTKMT2AMEN1
SCHEMBL6938389 0.82 RXFP1 (0.47) SMN1; SMN2L3MBTL1HTTKMT2AMEN1
SCHEMBL1488124 0.81 SMN1; SMN2 (0.67) SMN1; SMN2L3MBTL1HTTKMT2AMEN1
SCHEMBL3818831 0.80 SMN1; SMN2 (1.00) SMN1; SMN2L3MBTL1HTTKMT2AMEN1
SCHEMBL11158565 0.80 MAPT (0.83) SMN1; SMN2L3MBTL1HTTKMT2AMEN1
SCHEMBL17518853 0.79 SMN1; SMN2 (0.64) SMN1; SMN2L3MBTL1HTTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240158401-A1 DERIVATIVES OF IMIDAZO[4,5-d]PYRIDAZINE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2024-05-16 US claimed
CN-117777113-A Piperidyl alkyl dihydroxyphthalide compound and preparation method and application thereof 四川大学 2024-03-29 CN claimed
EP-4288438-A1 DERIVATIVES OF IMIDAZO[4,5-D]PYRIDAZINE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION Sanofi (FR) 2023-12-13 EP claimed
WO-2022167438-A1 DERIVATIVES OF IMIDAZO[4,5-d]PYRIDAZINE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2022-08-11 WO claimed
CN-110669058-A Tricyclic quinolone carboxylic acid and preparation method thereof 江西农业大学 2020-01-10 CN claimed
US-20190248785-A1 SUBSTITUTED POLYCYCLIC CARBAMOYL PYRIDONE DERIVATIVE PRODRUG SHIONOGI & CO., LTD. (JP) 2019-08-15 US claimed
CN-109748780-A The synthetic method of a kind of four poly- benzyl compounds 中国医学科学院药物研究所 2019-05-14 CN claimed
WO-2019025153-A1 USE OF SUBSTITUTED N-SULFONYL-N'-ARYL DIAMINOALKANES AND N-SULFONYL-N'-HETEROARYL DIAMINOALKANES OR SALTS THEREOF FOR INCREASING THE STRESS TOLERANCE IN PLANTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-02-07 WO claimed
US-20170015695-A1 PREPARATION OF MONOSACCHARIDES, DISACCHARIDES, TRISACCHARIDES, AND PENTASACCHARIDES OF HEPARINOIDS FORMOSA LABORATORIES, INC. (TW) 2017-01-19 US claimed
EP-3112352-A1 OPIOID RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2017-01-04 EP claimed
WO-1995005376-A1 SUBSTITUTED 2(5H)FURANONE, 2(5H)THIOPHENONE AND 2(5H)PYRROLONE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ENDOTHELIN ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1995-02-23 WO claimed
US-4670592-A BACTERICIDES, FUNGICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-06-02 US claimed
US-4574123-A BACTERICIDES, FUNGICIDES, STERILIZATION, CONTRACEPTIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-03-04 US claimed
US-4567174-A BACTERICIDES, FUNGICIDES, CONTRACEPTIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-01-28 US claimed
EP-0126567-A1 Bis(1-substituted biguanide) derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-28 EP claimed
EP-0125827-A1 Polyether bisbiguanides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-21 EP claimed
EP-0125092-A1 Bisbiguanide compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-14 EP claimed
EP-0125093-A1 Diaz(ep)ine bis(N-amidinoamidine) derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-14 EP claimed
EP-0125091-A2 4,4'-Alkylenedipiperidine derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-14 EP claimed
US-4472424-A Esters of 2-thenoylmercaptopropionylglycine with substituted hydroxybenzenes, process for their preparation and pharmaceutical compositions containing same SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 1984-09-18 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20170015695-A1 PREPARATION OF MONOSACCHARIDES, DISACCHARIDES, TRISACCHARIDES, AND PENTASACCHARIDES OF HEPARINOIDS HPSE, DDOST, FUT5 SMN1; SMN2 3743/4885L3MBTL1 4817/4885HTT 794/4885
US-20190248785-A1 SUBSTITUTED POLYCYCLIC CARBAMOYL PYRIDONE DERIVATIVE PRODRUG PREP, UNG, DPP4 SMN1; SMN2 4304/4885L3MBTL1 2179/4885HTT 4328/4885
US-20240158401-A1 DERIVATIVES OF IMIDAZO[4,5-d]PYRIDAZINE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION TLR7, TLR8, TLR6 SMN1; SMN2 3096/4885L3MBTL1 3168/4885HTT 3853/4885

“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.