SCHEMBL7048960

SCHEMBL7048960

COC(=O)CNNC(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.54
CA14 Q9ULX7 3/20 0.54
CA2 P00918 2/20 0.54
APLNR P35414 1/20 0.42
TET2 Q6N021 1/20 0.41
RECQL P46063 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
DGAT1 O75907 1/20 0.38
CA1 P00915 2/20 0.37
CA7 P43166 2/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
CYP2D6 P10635 1/20 0.37
GAA P10253 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL9176308 0.90 CA2 (0.43) CA12CA14CA2APLNRTDP1
SCHEMBL1060092 0.83 CYP1A2 (0.46) CA12CA14CA2APLNRGAA
SCHEMBL3164804 0.82 APLNR (0.43) CA12CA14CA2APLNRTDP1
SCHEMBL19362876 0.81 APLNR (0.46) CA12CA14CA2APLNRTDP1
SCHEMBL523837 0.81 CA2 (0.59) CA12CA14CA2TET2RECQL
SCHEMBL20759982 0.80 MAOA (0.51) CA12CA14CA2APLNRTDP1
SCHEMBL2671811 0.78 APLNR (0.41) CA12CA14CA2APLNRTDP1
SCHEMBL22946544 0.77 APLNR (0.44) CA12CA14CA2APLNRTDP1
SCHEMBL2776487 0.77 APLNR (0.46) CA12CA14CA2APLNRTDP1
SCHEMBL3177106 0.75 APLNR (0.44) CA12CA14CA2APLNRTDP1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111954673-B New penam derivatives or salts thereof, pharmaceutical compositions and uses thereof 富士胶片株式会社 2023-09-05 CN disclosed
WO-2022264114-A2 ROS SENSITIVE DIAZABORINES FOR THE CONSTRUCTION OF STIMULI-RESPONSIVE BIOCONJUGATES TECHNOPHAGE, INVESTIGAÇÃO E DESENVOLVIMENTO EM BIOTECHNOLOGIA, S.A. (PT) 2022-12-22 WO disclosed
CN-114531850-A Pharmaceutical composition and kit characterized by containing novel penicillin derivative or salt thereof and 1 or more compounds selected from beta-lactamase inhibitory compound and antibacterial compound or salt thereof 富士胶片株式会社 2022-05-24 CN disclosed
WO-2021066149-A1 PHARMACEUTICAL COMPOSITION AND KIT CHARACTERIZED BY CONTAINING NOVEL PENAM DERIVATIVE OR SALT THEREOF AND ONE OR MORE COMPOUNDS SELECTED FROM Β-LACTAMASE INHIBITOR COMPOUND, ANTIBACTERIAL COMPOUND AND SALTS OF THESE 富士フイルム株式会社 2021-04-08 WO disclosed
CN-111954673-A Novel penam derivative or salt thereof, pharmaceutical composition, and use thereof 富士胶片株式会社 2020-11-17 CN disclosed
WO-2019194306-A1 NOVEL PENAM DERIVATIVES OR SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF 富士フイルム株式会社 2019-10-10 WO disclosed
US-20030216441-A1 Farnesyltransferase inhibitors WEINSTOCK, STEVEN F. 2003-11-20 US disclosed
US-5567840-A AS 4-AMINOBUTYRIC ACID AGONIST; MUSCLE RELAXANTS CIBA-GEIGY CORPORATION (US) 1996-10-22 US disclosed
US-5461040-A Therapy of spinal spacticity, multiple sclerosis, cerebral palsy, trigeminus neuralgia, drug withdrawal, pain CIBA-GEIGY CORPORATION (US) 1995-10-24 US disclosed
EP-0399949-B1 Substituted aminoalkylphosphinic acids CIBA GEIGY AG (CH) 1995-04-12 EP disclosed
US-5281747-A Pharmaceuticals CIBA-GEIGY CORPORATION (US) 1994-01-25 US disclosed
EP-0399949-A1 Substituted aminoalkylphosphinic acids CIBA-GEIGY AG (CH) 1990-11-28 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 (1 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-20030216441-A1 Farnesyltransferase inhibitors FNTA, FNTB, LCAT CA12 4109/4885CA14 3866/4885CA2 4010/4885

“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.