SCHEMBL6833284

SCHEMBL6833284

Cc1cc(CC(=O)Nc2cccc3cc(C(=O)Nc4ccc(C#N)cc4C(=O)O)[nH]c23)on1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.39
ALDH1A1 P00352 1/20 0.39
ALB P02768 2/20 0.38
POLB P06746 1/20 0.37
NSD2 O96028 1/20 0.36
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
TYMS P04818 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
VHL P40337 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NHERF1 O14745 1/20 0.34

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
SCHEMBL6710423 0.86 ALDH1A1 (0.37) PKMALDH1A1POLBNSD2HDAC3
SCHEMBL6834072 0.84 ALDH1A1 (0.41) PKMALDH1A1ALBNSD2MEN1
SCHEMBL6707676 0.84 ALDH1A1 (0.36) PKMALDH1A1POLBNSD2HDAC3
SCHEMBL6834504 0.84 LMNA (0.47) PKMALDH1A1ALBMEN1KMT2A
SCHEMBL6830151 0.84 ALB (0.42) ALBPOLBNSD2NR1H4KMT2A
SCHEMBL6833157 0.84 PARP14 (0.42) PKMALDH1A1ALBPOLBNSD2
SCHEMBL6830741 0.84 ALDH1A1 (0.47) ALDH1A1ALBPOLBNSD2HDAC3
SCHEMBL6830655 0.83 ALB (0.43) ALDH1A1ALBPOLBNSD2NR1H4
SCHEMBL6833910 0.82 KDM4E (0.45) PKMALDH1A1ALBPOLBNSD2
SCHEMBL6833897 0.82 ALB (0.42) PKMALBPOLBNSD2HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 US claimed
US-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 US disclosed
WO-2004018428-A1 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 PKM 3785/4885ALDH1A1 170/4885ALB 1417/4885

“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.