SCHEMBL6358920

SCHEMBL6358920

CN(c1ccc(Cl)cc1)S(=O)(=O)c1ccc(C(=O)Nc2ccc([N+](=O)OC(=O)c3cc(Br)ccc3NC(=O)c3ccc(N4CCOCC4)c(S(=O)(=O)N(C)c4ccc(Cl)cc4)c3)cc2C(=O)OC(=O)c2cc([N+](=O)[O-])ccc2NC(=O)c2cccc(S(=O)(=O)N(C)c3ccc(Cl)cc3)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALB P02768 2/20 0.44
ALDH1A1 P00352 6/20 0.43
LMNA P02545 5/20 0.43
RXFP1 Q9HBX9 1/20 0.43
HTT P42858 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SIRT2 Q8IXJ6 4/20 0.39
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL6358917 0.91 ALB (0.54) ALBALDH1A1LMNARXFP1HTT
SCHEMBL6351777 0.78 ALB (0.51) ALBALDH1A1LMNAHTTMAPT
SCHEMBL6360161 0.73 SIRT2 (0.59) ALBALDH1A1LMNAHTTMAPT
SCHEMBL6913280 0.71 SIRT2 (0.49) MAPTSMN1; SMN2SIRT2
SCHEMBL6353746 0.70 SIRT2 (0.61) ALBALDH1A1LMNAHTTMAPT
SCHEMBL6347994 0.70 KCNK2 (0.52) ALBALDH1A1HTTMAPTKDM4E
SCHEMBL6708651 0.68 SIRT2 (0.60) ALDH1A1LMNAHTTMAPTNPC1
SCHEMBL15838844 0.68 SIRT2 (0.75) ALDH1A1LMNAMAPTNPC1SIRT2
SCHEMBL6349554 0.67 AKR1C2 (0.48) HTTKDM4ESIRT2MEN1KMT2A
SCHEMBL6351360 0.67 METAP2 (0.55) LMNAHTTMAPTKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050113450-A1 Antibacterial agents PHARMACIA & UPJOHN COMPANY 2005-05-26 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 (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-20050113450-A1 Antibacterial agents CLPP, SPOUT1, SAMHD1 ALB 1682/4885ALDH1A1 462/4885LMNA 4552/4885

“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.