SCHEMBL6833249

SCHEMBL6833249

Cc1ccccc1-c1ccc2c(C(=O)Nc3ccc(C#N)cc3C(=O)O)noc2c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.41
HIF1A Q16665 5/20 0.38
MAPT P10636 1/20 0.38
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
ALB P02768 2/20 0.38
PRSS12 P56730 1/20 0.38
MAPK14 Q16539 1/20 0.37
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
CETP P11597 1/20 0.36
SERPINE1 P05121 1/20 0.36
NR1H4 Q96RI1 1/20 0.36
LRRK2 Q5S007 1/20 0.36
KDM4C Q9H3R0 2/20 0.36
XDH P47989 1/20 0.36
SLC22A12 Q96S37 1/20 0.36

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
SCHEMBL6833960 0.93 MCL1 (0.43) MCL1HIF1AMAPTGSK3AGSK3B
SCHEMBL6834160 0.90 HIF1A (0.39) HIF1AMAPTGSK3AGSK3BALB
SCHEMBL6833104 0.89 HIF1A (0.49) HIF1AALBPRSS12SERPINE1XDH
SCHEMBL6830592 0.87 EPHX2 (0.43) HIF1AMAPTALBPRSS12CETP
SCHEMBL6818765 0.86 ALB (0.37) HIF1AMAPTGSK3AGSK3BALB
SCHEMBL6818998 0.86 HIF1A (0.39) HIF1AMAPTGSK3AGSK3BALB
SCHEMBL6817639 0.85 ALB (0.36) HIF1AMAPTGSK3AGSK3BALB
SCHEMBL6821275 0.84 HIF1A (0.38) MCL1HIF1AMAPTGSK3AGSK3B
Sulfuric Acid SCHEMBL6833366 0.84 EPHX2 (0.41) HIF1AMAPTALBPRSS12CETP
SCHEMBL6818903 0.84 PRSS12 (0.40) MCL1MAPTGSK3AGSK3BALB

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 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 MCL1 2086/4885HIF1A 220/4885MAPT 4759/4885

“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.