SCHEMBL6834149

SCHEMBL6834149

N#Cc1ccc(NC(=O)c2cc3cccc(NC(=O)CCCCc4ccccc4)c3[nH]2)c(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.48
HDAC3 O15379 5/20 0.43
HDAC1 Q13547 5/20 0.43
CCKAR P32238 3/20 0.41
CCKBR P32239 3/20 0.41
PLK1 P53350 3/20 0.40
PLK3 Q9H4B4 3/20 0.40
HDAC4 P56524 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40

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
SCHEMBL6834150 0.97 HCAR2 (0.44) HCAR2HDAC3HDAC1CCKARCCKBR
SCHEMBL6834023 0.94 HCAR2 (0.43) HCAR2CCKARCCKBR
SCHEMBL6833331 0.90 PTPN2 (0.44) HDAC3HDAC1PLK1PLK3
SCHEMBL6834575 0.89 PTPN2 (0.46) HDAC3HDAC1PLK1PLK3
SCHEMBL6834131 0.89 PTPN2 (0.46) HDAC3HDAC1PLK1PLK3
SCHEMBL6830691 0.89 PLK1 (0.47) HCAR2HDAC3HDAC1PLK1PLK3
SCHEMBL6835693 0.89 POLB (0.47) HDAC3HDAC1PLK1
SCHEMBL6834504 0.89 LMNA (0.47) CCKARCCKBR
SCHEMBL6834088 0.87 HDAC3 (0.46) HCAR2HDAC3HDAC1
SCHEMBL6833910 0.87 KDM4E (0.45) HDAC3HDAC1

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 2 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

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 HCAR2 344/4885HDAC3 1562/4885HDAC1 1902/4885

“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.