SCHEMBL3209900

SCHEMBL3209900

COCCOc1ccc(/C=C/C(=O)O)c(OCC2CCCO2)c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.55
APP P05067 1/20 0.55
RAB9A P51151 7/20 0.43
NPC1 O15118 6/20 0.43
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
HDAC8 Q9BY41 1/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
KDM4E B2RXH2 4/20 0.42
MEN1 O00255 3/20 0.42
ALDH1A1 P00352 3/20 0.42
KMT2A Q03164 3/20 0.42
HPGD P15428 2/20 0.42
TP53 P04637 1/20 0.42
LMNA P02545 3/20 0.42
TDP1 Q9NUW8 1/20 0.41
MAPK1 P28482 1/20 0.41
SCN9A Q15858 1/20 0.41

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
SCHEMBL3209916 1.00 MAPT (0.55) MAPTAPPRAB9ANPC1CASP3
SCHEMBL27716315 0.89 MAPT (0.52) MAPTAPPRAB9ANPC1CASP3
SCHEMBL3216053 0.84 HDAC8 (0.47) MAPTRAB9ANPC1HDAC8SMN1; SMN2
SCHEMBL3216064 0.84 HDAC8 (0.47) MAPTRAB9ANPC1HDAC8SMN1; SMN2
SCHEMBL3205183 0.84 PARP10 (0.48) MAPTHDAC8MEN1ALDH1A1KMT2A
SCHEMBL3205195 0.84 PARP10 (0.48) MAPTHDAC8MEN1ALDH1A1KMT2A
SCHEMBL3211257 0.82 PPARG (0.60) MAPTAPPHDAC8SMN1; SMN2KDM4E
SCHEMBL3211247 0.82 PPARG (0.60) MAPTAPPHDAC8SMN1; SMN2KDM4E
SCHEMBL3204951 0.79 FFAR1 (0.54) MAPTAPPRAB9ANPC1CASP3
SCHEMBL3202826 0.79 HDAC8 (0.43) MAPTAPPHDAC8MEN1ALDH1A1

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-20100041892-A1 Therapeutic agent for diabetes ABE HIDENORI 2010-02-18 US disclosed
US-20090270631-A1 Therapeutic agent for diabetes ABE HIDENORI 2009-10-29 US disclosed
EP-1912645-A2 THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2008-04-23 EP disclosed
US-20080009530-A1 Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-10 US disclosed
WO-2007018314-A2 THERAPEUTIC AGENT FOR DIABETES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 WO 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 (3 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-20090270631-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 MAPT 4588/4885APP 3197/4885RAB9A 3599/4885
US-20080009530-A1 Therapeutic Agent for Diabetes FABP4, SLC5A1, SLC5A2 MAPT 4612/4885APP 3588/4885RAB9A 3729/4885
US-20100041892-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 MAPT 4588/4885APP 3197/4885RAB9A 3599/4885

“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.