SCHEMBL4340010

SCHEMBL4340010

CC(C)OC(Cc1cccc(NC(=O)OCc2ccc3c(c2)CCO3)c1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 2/20 0.44
ATM Q13315 2/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
FAAH O00519 1/20 0.41
MGLL Q99685 2/20 0.41
CHRM5 P08912 2/20 0.39
CHRM1 P11229 2/20 0.39
ENPP2 Q13822 2/20 0.39
ACACB O00763 1/20 0.38
ROCK2 O75116 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM3 P20309 1/20 0.37

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
SCHEMBL4333329 0.91 RAB9A (0.45) NPC1RAB9APOLBMAPTATM
SCHEMBL4342740 0.86 RAB9A (0.59) NPC1RAB9APOLBMAPTATM
SCHEMBL4335253 0.84 MMP1 (0.40) NPC1RAB9APOLBCHRM5CHRM1
SCHEMBL4346128 0.82 MEN1 (0.47) MAPTALDH1A1MGLLENPP2
SCHEMBL4328906 0.81 MGLL (0.52) POLBMAPTMGLLENPP2ROCK2
SCHEMBL4332402 0.80 MGLL (0.50) MGLLENPP2
SCHEMBL4343575 0.80 MGLL (0.49) MGLLENPP2
SCHEMBL4340006 0.79 MGLL (0.44) MGLLENPP2ROCK2
SCHEMBL4343745 0.79 MGLL (0.45) MGLLENPP2
SCHEMBL4328989 0.78 MGLL (0.43) MAPTSMN1; SMN2MGLLENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-20040102634-A1 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-05-27 US disclosed
EP-1380562-A1 CARBOXYLIC ACID DERIVATIVE AND SALT THEREOF Eisai Co., Ltd. (JP) 2004-01-14 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-20040102634-A1 Carboxylic acid derivative and salt thereof GPR119, IRS1, SLC5A1 NPC1 603/4885RAB9A 2956/4885POLB 3622/4885

“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.