SCHEMBL6403439

SCHEMBL6403439

SC1CCN(CCc2ccccc2)C1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.60
CCR3 P51677 1/20 0.58
CYP1A2 P05177 2/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2D6 P10635 2/20 0.57
CYP2C19 P33261 1/20 0.57
SLC6A3 Q01959 1/20 0.55
SIGMAR1 Q99720 2/20 0.53
MAOA P21397 1/20 0.51
HTR2A P28223 3/20 0.51
HTR2C P28335 2/20 0.51
KCNH2 Q12809 1/20 0.51
KDM4E B2RXH2 1/20 0.51
TSHR P16473 1/20 0.51

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
SCHEMBL6399343 0.90 SIGMAR1 (0.61) CCR3CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL9030685 0.89 ACHE (0.69) ACHECCR3CYP1A2CYP3A4CYP2D6
SCHEMBL171303 0.82 CYP1A2 (0.81) ACHECCR3CYP1A2CYP3A4CYP2D6
SCHEMBL6399821 0.82 CYP1A2 (0.81) ACHECCR3CYP1A2CYP3A4CYP2D6
SCHEMBL5416627 0.80 CYP1A2 (0.50) ACHECCR3CYP1A2CYP3A4CYP2D6
SCHEMBL5534146 0.79 ACHE (0.60) ACHECCR3CYP1A2CYP3A4CYP2D6
SCHEMBL7724029 0.79 LTA4H (0.61) ACHECCR3CYP1A2CYP3A4CYP2D6
SCHEMBL6423692 0.79 ACHE (0.60) ACHECCR3CYP1A2CYP3A4CYP2D6
SCHEMBL5537485 0.79 ACHE (0.60) ACHECCR3CYP1A2CYP3A4CYP2D6
SCHEMBL4222408 0.79 LTA4H (0.61) ACHECCR3CYP1A2CYP3A4CYP2D6

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 6 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
US-6051569-A 1'S, 5R, 6R-carbapenem derivatives and antimicrobial agents comprising the same SUNTORY LIMITED (JP) 2000-04-18 US disclosed
EP-0826687-A1 Carbapenem derivatives and antimicrobial agents comprising the same SUNTORY LIMITED (JP) 1998-03-04 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 ACHE 2285/4885CCR3 4703/4885CYP1A2 3030/4885

“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.