SCHEMBL4337000

SCHEMBL4337000

CCOc1ccc(CC(OC(C)C)C(=O)O)cc1COC(=O)Nc1ccc(OC)cc1OC

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 3/20 0.40
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
LPAR1 Q92633 2/20 0.39
KDM4E B2RXH2 1/20 0.39
RECQL P46063 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TP53 P04637 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL13810555 0.89 PPARG (0.41) LMNATSHRALDH1A1NPC1RAB9A
SCHEMBL4328226 0.87 MMP1 (0.44) MAPTLMNAALDH1A1RAB9AKDM4E
SCHEMBL4333270 0.86 ALDH1A1 (0.47) MAPTGAAALDH1A1TAS1R3TAS1R1
SCHEMBL13810563 0.86 MTNR1B (0.46) MAPTLMNAGAATSHRNPSR1
SCHEMBL4334222 0.85 SMN1; SMN2 (0.48) MAPTLMNAGAAALDH1A1RAB9A
SCHEMBL13810562 0.85 PPARG (0.42) MAPTLMNAGAAALDH1A1NPC1
SCHEMBL4327205 0.85 ATM (0.42) MAPTLMNATSHRNPSR1ALDH1A1
SCHEMBL4335802 0.83 SMN1; SMN2 (0.43) MAPTLMNAGAAALDH1A1KDM4E
SCHEMBL4347051 0.83 POLB (0.41) KDM4ERECQLMEN1KMT2A
SCHEMBL4332405 0.83 SMN1; SMN2 (0.43) MAPTLMNAGAAALDH1A1KDM4E

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 4 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

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 MAPT 4654/4885LMNA 3790/4885GAA 2303/4885

“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.