SCHEMBL3202477

SCHEMBL3202477

COCOc1cc(OCCCOCC2CC2)ccc1C=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.41
ALDH1A1 P00352 1/20 0.40
HDAC8 Q9BY41 3/20 0.36
HPGD P15428 1/20 0.35
PARP15 Q460N3 2/20 0.35
PARP10 Q53GL7 2/20 0.35
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
PPARD Q03181 2/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
ERN1 O75460 1/20 0.33
TUBB1 Q9H4B7 1/20 0.33
PPARA Q07869 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL15189007 0.82 ALDH1A1 (0.49) MAOBALDH1A1HDAC8ERN1TUBB1
SCHEMBL3200445 0.80 ALDH1A1 (0.56) MAOBALDH1A1HDAC8HPGDERN1
SCHEMBL3211256 0.80 ALDH1A1 (0.46) MAOBALDH1A1HDAC8HPGDERN1
SCHEMBL1390531 0.78 ACACB (0.40) ALDH1A1HPGDPARP15PARP10
SCHEMBL15968477 0.77 ALDH1A1 (0.61) MAOBALDH1A1HPGDPARP15PARP10
SCHEMBL3209556 0.76 ALDH1A1 (0.69) MAOBALDH1A1HDAC8ERN1
SCHEMBL4998794 0.74 ALDH1A1 (0.49) MAOBALDH1A1HDAC8HPGDERN1
SCHEMBL3905573 0.73 ALDH1A1 (0.69) MAOBALDH1A1ERN1TUBB1POLB
SCHEMBL6690243 0.73 ALDH1A1 (0.59) MAOBALDH1A1HPGDPARP15PARP10
SCHEMBL4064858 0.72 ALDH1A1 (0.51) MAOBALDH1A1HDAC8HPGDERN1

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 MAOB 2436/4885ALDH1A1 212/4885HDAC8 789/4885
US-20080009530-A1 Therapeutic Agent for Diabetes FABP4, SLC5A1, SLC5A2 MAOB 2145/4885ALDH1A1 118/4885HDAC8 663/4885
US-20100041892-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 MAOB 2436/4885ALDH1A1 212/4885HDAC8 789/4885

“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.