SCHEMBL6834339

SCHEMBL6834339

COc1ccc(-c2ccc3cc(C(=O)Nc4ccc(C#N)cc4C(=O)O)n(C)c3c2)c(OC)c1OC

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.39
LCK P06239 10/20 0.39
HCK P08631 4/20 0.39
FYN P06241 1/20 0.38
SLC22A12 Q96S37 1/20 0.36
BRD1 O95696 1/20 0.36
BRPF1 P55201 1/20 0.36
BRD9 Q9H8M2 1/20 0.36
BRPF3 Q9ULD4 1/20 0.36
ALB P02768 3/20 0.36
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
TRPA1 O75762 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 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
SCHEMBL6707942 0.83 LCK (0.37) MAPTLCKHCKFYNBRD1
SCHEMBL6835702 0.82 MAPT (0.47) MAPTALBLMNATP53ALDH1A1
SCHEMBL6833879 0.82 LMNA (0.43) MAPTLCKHCKALBLMNA
SCHEMBL6709959 0.82 LCK (0.38) MAPTLCKHCKFYNBRD1
SCHEMBL6835707 0.81 ALB (0.41) MAPTALBLMNATP53TRPA1
SCHEMBL6835629 0.79 ALB (0.39) MAPTSLC22A12ALBLMNATP53
SCHEMBL6830517 0.78 MAPT (0.51) MAPTTP53ALDH1A1TSHR
SCHEMBL6818878 0.77 ALB (0.56) MAPTLCKALBLMNATP53
SCHEMBL6818253 0.77 ROCK2 (0.42) MAPTALBLMNATP53TRPA1
SCHEMBL6833234 0.76 KDM4C (0.43) MAPTALBLMNATP53ALDH1A1

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 MAPT 4759/4885LCK 4004/4885HCK 3236/4885

“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.