SCHEMBL2278113

SCHEMBL2278113

O=C(Nc1cc(CCc2ccccc2)ccc1C(=O)O)C1=COC(Cc2ccccc2)O1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
PLK1 P53350 6/20 0.38
PLK3 Q9H4B4 4/20 0.38
MCL1 Q07820 1/20 0.37
BCL2A1 Q16548 1/20 0.37
LTC4S Q16873 1/20 0.37
PRSS12 P56730 3/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
GRIK1 P39086 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 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
SCHEMBL2273187 0.87 ACLY (0.49) MCL1ACLY
SCHEMBL2272547 0.85 ACLY (0.40) NPC1ALDH1A1HPGDRAB9AMCL1
SCHEMBL2267869 0.84 CYP2C9 (0.45) KMT2AMCL1PRSS12MAPT
SCHEMBL2277761 0.84 ACLY (0.44) MCL1PRSS12ACLYHCAR2
SCHEMBL2274220 0.82 ACLY (0.49) GRIK1ACLYHCAR2
SCHEMBL2275462 0.80 HDAC2 (0.48) NPC1ALDH1A1HPGDRAB9AMEN1
SCHEMBL2276665 0.80 TTR (0.41) NPC1ALDH1A1HPGDMEN1KMT2A
SCHEMBL7128829 0.78 PYGL (0.55)
SCHEMBL2275929 0.76 KMT2A (0.62) MEN1KMT2ATDP1PLK1PLK3
SCHEMBL2274797 0.75 MEN1 (0.46) NPC1ALDH1A1HPGDRAB9AMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7999132-B2 Anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO., LTD. (JP) 2011-08-16 US disclosed
US-20090240052-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2009-09-24 US disclosed
EP-1820795-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2007-08-22 EP 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-20090240052-A1 NOVEL ANTHRANILIC ACID DERIVATIVE OR SALT THEREOF MMP13, MMP26, MMP11 NPC1 4836/4885ALDH1A1 645/4885HPGD 274/4885

“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.