SCHEMBL6833807

SCHEMBL6833807

CCOC(=O)c1noc2cc(Cl)ccc12

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
KMT2A Q03164 1/20 0.50
MAOB P27338 1/20 0.49
MAPT P10636 1/20 0.48
TARBP2 Q15633 1/20 0.47
KDM4E B2RXH2 3/20 0.45
ALOX15 P16050 5/20 0.45
ELANE P08246 2/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GAA P10253 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL25408093 0.89 MAOB (0.55) ALDH1A1MAOBMAPTTARBP2KDM4E
SCHEMBL31435424 0.89 MAOB (0.55) ALDH1A1MAOBMAPTTARBP2KDM4E
SCHEMBL492496 0.84 AKR1B1 (0.54) ALDH1A1KMT2AMAOBMAPTKDM4E
SCHEMBL11793990 0.84 ALDH1A1 (0.53) ALDH1A1KMT2AMAPTKDM4EHPGD
SCHEMBL492231 0.83 TBK1 (0.48) ALDH1A1MAPTTARBP2KDM4EELANE
SCHEMBL8226588 0.83 HTT (0.50) ALDH1A1MAPTKDM4EELANESMN1; SMN2
SCHEMBL14492918 0.83 KDM4E (0.42) ALDH1A1KMT2ATARBP2KDM4E
SCHEMBL492601 0.83 LMNA (0.46) ALDH1A1KMT2AMAPTKDM4EALOX15
SCHEMBL491943 0.82 KDM4E (0.50) ALDH1A1KMT2AMAOBMAPTTARBP2
SCHEMBL2815397 0.80 ESR1 (0.44) ALDH1A1KMT2ATARBP2HPGDGAA

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 ALDH1A1 170/4885KMT2A 2853/4885MAOB 1623/4885

“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.