SCHEMBL6830873

SCHEMBL6830873

Cn1c(C(=O)Nc2ccc(C#N)cc2C(=O)O)cc2cccc(NC(=O)Cc3ccc(F)cc3)c21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.38
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 4/20 0.38
PKM P14618 2/20 0.38
ATM Q13315 1/20 0.37
MAPK1 P28482 1/20 0.37
HPGD P15428 1/20 0.36
KCNQ2 O43526 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
CNR2 P34972 1/20 0.36
ALB P02768 1/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
GPR6 P46095 1/20 0.35

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
SCHEMBL6833763 0.88 ALB (0.39) LMNAPKMALBKMT2AMEN1
SCHEMBL6710533 0.82 ALDH1A1 (0.34) LMNAALDH1A1KDM4EPKMATM
SCHEMBL6833427 0.82 ALB (0.50) LMNAALBKMT2AMEN1
SCHEMBL6835787 0.81 CFD (0.47) LMNAALDH1A1KDM4EHPGDALB
SCHEMBL6709143 0.81 ALDH1A1 (0.35) LMNAALDH1A1PKMATM
SCHEMBL6833985 0.80 ALB (0.42) LMNAALDH1A1ALBKMT2AMEN1
SCHEMBL6834048 0.80 ALB (0.42) LMNAPKMALBKMT2A
SCHEMBL6834424 0.80 ALB (0.43) LMNAPKMATMALBKMT2A
SCHEMBL6830543 0.80 ALDH1A1 (0.43) LMNAALDH1A1KDM4EPKMALB
SCHEMBL6835671 0.80 LMNA (0.39) LMNAPKMMAPK1ALB

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-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 US claimed

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 LMNA 3376/4885ALDH1A1 170/4885KDM4E 1240/4885

“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.