SCHEMBL6707789

SCHEMBL6707789

CSCCOc1cccc2cc(C(=O)Nc3ccc(C#N)cc3-c3nnn[nH]3)n(C)c12

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
BRD4 O60885 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
BDKRB2 P30411 1/20 0.31
MCHR1 Q99705 1/20 0.31
KDM1A O60341 1/20 0.31
ROCK2 O75116 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL6708936 0.92 KDM1A (0.34) LMNAMAPTRXFP1BRD4SMN1; SMN2
SCHEMBL6710432 0.90 LMNA (0.35) LMNAMAPTRXFP1BRD4SMN1; SMN2
SCHEMBL6709981 0.90 LMNA (0.35) LMNAMAPTRXFP1BRD4SMN1; SMN2
SCHEMBL6710193 0.89 PPARG (0.36) LMNAMAPTRXFP1SMN1; SMN2
SCHEMBL6710109 0.89 NPSR1 (0.35) LMNAMAPTRXFP1HSD17B10
SCHEMBL6713474 0.88 RXFP1 (0.33) LMNAMAPTRXFP1SMN1; SMN2HSD17B10
SCHEMBL6710365 0.87 KDM1A (0.39) LMNAMAPTRXFP1BRD4KDM1A
SCHEMBL6709131 0.87 PPIA (0.39) LMNAMAPTRXFP1KDM1A
SCHEMBL6711750 0.86 KDM1A (0.39) LMNAMAPTRXFP1KDM1A
SCHEMBL6710191 0.86 ALK (0.38) LMNAMAPTRXFP1SMN1; SMN2HSD17B10

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-20040142981-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-07-22 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-20040142981-A1 Antibacterial benzoic acid derivatives GABRD, PHB1, GABBR1 LMNA 4062/4885MAPT 4754/4885RXFP1 3836/4885

“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.