SCHEMBL14487

SCHEMBL14487

NCCCNCc1ccc(-n2cc3cc(CCS(=O)(=O)N(Cc4ccc(Cl)c(Cl)c4)C4CCNCC4)[nH]c3nc2=O)cc1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31
KCNH2 Q12809 2/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
RORC P51449 1/20 0.30

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
SCHEMBL12061821 0.88 PRMT5 (0.33) PRMT5WDR77SLC6A2SLC6A4SLC6A3
SCHEMBL14013 0.87 EZH2 (0.33)
SCHEMBL14355 0.84 AVPR1B (0.38) PRMT5WDR77
SCHEMBL14335 0.81
SCHEMBL13738 0.78 CXCR4 (0.36)
SCHEMBL14277 0.76 AVPR1B (0.35) PRMT5WDR77
SCHEMBL13822 0.76 MC4R (0.38)
SCHEMBL14233 0.74 PSEN1 (0.36) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2
SCHEMBL12061895 0.74 PSEN1 (0.39) SLC6A2SLC6A4SLC6A3KCNH2CYP1A2
SCHEMBL12061619 0.73 AVPR1B (0.35) SLC6A2SLC6A4SLC6A3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160031893-A1 ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME BioVersys AG (CH) 2016-02-04 US disclosed
WO-2011047319-A2 ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME RIB-X PHARMACEUTICALS, INC. (US) 2011-04-21 WO 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-20160031893-A1 ANTIMICROBIAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME MPO, LPO, CAT PRMT5 1761/4885WDR77 3385/4885SLC6A2 3776/4885

“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.