SCHEMBL40674

SCHEMBL40674

CC(C(=O)O)N(C)Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.57
MEN1 O00255 5/20 0.57
ADRA2B P18089 1/20 0.56
ADRA2C P18825 1/20 0.56
SLC6A2 P23975 1/20 0.56
HTR2A P28223 1/20 0.56
SLC6A4 P31645 1/20 0.56
ADRA1A P35348 1/20 0.56
OPRK1 P41145 1/20 0.56
SLC6A3 Q01959 1/20 0.56
KCNH2 Q12809 1/20 0.56
HPGD P15428 1/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
CA12 O43570 1/20 0.52
CA9 Q16790 1/20 0.52
ALDH1A1 P00352 2/20 0.48
TSHR P16473 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ATM Q13315 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
SCHEMBL3054171 1.00 KMT2A (0.57) KMT2AMEN1ADRA2BADRA2CSLC6A2
SCHEMBL7144646 1.00 KMT2A (0.57) KMT2AMEN1ADRA2BADRA2CSLC6A2
Hydrochloric Acid SCHEMBL29247750 0.98 KMT2A (0.56) KMT2AMEN1ADRA2BADRA2CSLC6A2
SCHEMBL10140576 0.87 KMT2A (0.57) KMT2AMEN1ADRA2BADRA2CSLC6A2
SCHEMBL890170 0.87 KMT2A (0.56) KMT2AMEN1ADRA2BADRA2CSLC6A2
SCHEMBL9267301 0.87 KMT2A (0.56) KMT2AMEN1ADRA2BADRA2CSLC6A2
SCHEMBL888819 0.85 KMT2A (0.55) KMT2AMEN1ADRA2BADRA2CSLC6A2
SCHEMBL17372647 0.85 KMT2A (0.55) KMT2AMEN1ADRA2BADRA2CSLC6A2
SCHEMBL19182844 0.85 KMT2A (0.55) KMT2AMEN1ADRA2BADRA2CSLC6A2
SCHEMBL13484482 0.85 KMT2A (0.55) KMT2AMEN1ADRA2BADRA2CSLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0319814-B1 METHOD OF PREPARING ASYMMETRICAL DIHYDROPYRIDINES BAYER AG (DE) 1992-09-16 EP claimed
EP-0319814-A2 Method of preparing asymmetrical dihydropyridines BAYER AG (DE) 1989-06-14 EP claimed
EP-3794944-B1 SAFENER NIPPON SODA CO (JP) 2023-10-18 EP disclosed
US-11753398-B2 Therapeutic compounds C4X DISCOVERY LIMITED (GB) 2023-09-12 US disclosed
WO-2023286855-A1 FORMAMIDE DERIVATIVE AND AGRICULTURAL OR HORTICULTURAL PLANT DISEASE CONTROL AGENT クミアイ化学工業株式会社 2023-01-19 WO disclosed
WO-2022239840-A1 STORAGE OF MICROORGANISM HAVING PLANT PROTECTING ABILITY 日本曹達株式会社 2022-11-17 WO disclosed
CN-112272518-B Chemical injury lightening agent 日本曹达株式会社 2022-06-07 CN disclosed
US-20210395227-A1 THERAPEUTIC COMPOUNDS INDIVIOR UK LIMITED (GB) 2021-12-23 US disclosed
US-11130746-B2 Therapeutic compounds C4X DISCOVERY LIMITED (GB) 2021-09-28 US disclosed
US-20210227825-A1 SAFENER NIPPON SODA CO., LTD. (JP) 2021-07-29 US disclosed
CN-112654621-A Substituted naphthyridinone compounds useful as T cell activators 百时美施贵宝公司 2021-04-13 CN disclosed
US-6451854-B1 α-amino acid phenyl ester derivatives AKZO NOBEL N.V. (NL) 2002-09-17 US disclosed
EP-1098871-A1 $g(a)-AMINO ACID PHENYL ESTER DERIVATIVES Akzo Nobel N.V. (NL) 2001-05-16 EP disclosed
CN-1053657-C Didepsipeptide-based endoparasiticidal compositions, novel depsipeptides and methods for their preparation BAYER AG (DE) 2000-06-21 CN disclosed
WO-2000005196-A1 α-AMINO ACID PHENYL ESTER DERIVATIVES AKZO NOBEL N.V. (NL) 2000-02-03 WO disclosed
EP-0349330-B1 Photographic material and process (B) EASTMAN KODAK CO (US) 1995-03-29 EP disclosed
EP-0319814-B1 METHOD OF PREPARING ASYMMETRICAL DIHYDROPYRIDINES BAYER AG (DE) 1992-09-16 EP disclosed
EP-0349330-A2 Photographic material and process (B) EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1990-01-03 EP disclosed
US-4857440-A RELEASING DYE UPON OXIDATIVE DEVELOPMENT OF SILVER HALIDE EMULSION EASTMAN KODAK COMPANY (US) 1989-08-15 US disclosed
US-4145432-A 6-ACYLORYALKYL-1,4-DIHYDROPYRIDINE DERIVATIVES AND A METHOD OF EFFECTING VASODILATION THEREWITH FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1979-03-20 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 (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-11753398-B2 Therapeutic compounds HCRTR2, HCRTR1, NPY1R KMT2A 2027/4885MEN1 713/4885ADRA2B 200/4885
US-11130746-B2 Therapeutic compounds HCRTR2, HCRTR1, NPY1R KMT2A 2027/4885MEN1 713/4885ADRA2B 200/4885
US-20210227825-A1 SAFENER CYP2W1, CYP4Z1, WEE1 KMT2A 452/4885MEN1 2522/4885ADRA2B 2104/4885
US-20210395227-A1 THERAPEUTIC COMPOUNDS HCRTR2, HCRTR1, NPY1R KMT2A 2027/4885MEN1 713/4885ADRA2B 200/4885

“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.