SCHEMBL6399006

SCHEMBL6399006

O=C(CN1CCC(O)C1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
HTR2A P28223 1/20 0.51
HTR2C P28335 1/20 0.51
KCNH2 Q12809 1/20 0.51
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
KMT2A Q03164 1/20 0.50
SIGMAR1 Q99720 1/20 0.49
BCHE P06276 2/20 0.47
ACHE P22303 2/20 0.47
KCNA3 P22001 1/20 0.46
TRPV6 Q9H1D0 1/20 0.46
OPRM1 P35372 1/20 0.46
OPRD1 P41143 1/20 0.46
OPRK1 P41145 1/20 0.46
CHRM3 P20309 1/20 0.46
GRIN2B Q13224 2/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46

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
SCHEMBL27406305 0.91 ALDH1A1 (0.59) ALDH1A1HTR2AHTR2CKCNH2LMNA
SCHEMBL6399748 0.86 ALDH1A1 (0.56) ALDH1A1KMT2ASIGMAR1GRIN2BSLC6A4
SCHEMBL6405297 0.84 ALDH1A1 (0.70) ALDH1A1LMNAGAAKMT2ASIGMAR1
SCHEMBL6403372 0.84 HTR2A (0.55) ALDH1A1HTR2AHTR2CKCNH2KMT2A
SCHEMBL6397229 0.84 KMT2A (0.59) ALDH1A1LMNAKMT2AGRIN2B
SCHEMBL6398067 0.83 ALDH1A1 (0.53) ALDH1A1HTR2AHTR2CKCNH2LMNA
SCHEMBL6398065 0.83 ALDH1A1 (0.53) ALDH1A1HTR2AHTR2CKCNH2LMNA
SCHEMBL6398848 0.81 ALDH1A1 (0.62) ALDH1A1LMNAKMT2AGRIN2B
SCHEMBL14095727 0.81 HTR2A (0.49) ALDH1A1HTR2AHTR2CKCNH2LMNA
SCHEMBL17428291 0.80 ALDH1A1 (0.50) ALDH1A1HTR2AHTR2CKCNH2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050004092-A1 Penem derivatives and antimicrobial agent containing the same DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2005-01-06 US disclosed
EP-0757051-B1 PENEM DERIVATIVES AND ANTIMICROBIAL AGENT CONTAINING THE SAME DAIICHI SUNTORY PHARMA CO LTD (JP) 2003-10-29 EP disclosed
EP-0774465-A1 Penem derivatives and antimicrobial agents containing the same SUNTORY LIMITED (JP) 1997-05-21 EP disclosed
EP-0757051-A1 PENEM DERIVATIVES AND ANTIMICROBIAL AGENT CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-02-05 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-20050004092-A1 Penem derivatives and antimicrobial agent containing the same MRPL21, MRPS2, MRPS28 ALDH1A1 1862/4885HTR2A 2168/4885HTR2C 3395/4885

“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.