SCHEMBL12578024

SCHEMBL12578024

COc1ccc(COc2ccc(C=O)cc2)cc1-c1c(C)cccc1C

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.67
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALDH1A1 P00352 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PDCD1 Q15116 1/20 0.46
CD274 Q9NZQ7 1/20 0.46
MAOB P27338 4/20 0.45
MAOA P21397 2/20 0.45
MAPT P10636 2/20 0.44
HPGD P15428 1/20 0.44
TUBB1 Q9H4B7 1/20 0.43

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
SCHEMBL12579679 0.88 FFAR1 (0.58) FFAR1RAB9ANPC1TDP1ALDH1A1
SCHEMBL12578008 0.88 RAB9A (0.57) FFAR1RAB9ANPC1TDP1ALDH1A1
SCHEMBL12578027 0.87 FFAR1 (0.53) FFAR1RAB9ANPC1TDP1ALDH1A1
SCHEMBL12577983 0.84 RAB9A (0.53) FFAR1RAB9ANPC1TDP1MAOB
SCHEMBL12578014 0.84 RAB9A (0.53) FFAR1RAB9ANPC1TDP1MAOB
SCHEMBL27892042 0.81 RAB9A (0.60) RAB9ANPC1TDP1ALDH1A1SMN1; SMN2
SCHEMBL1746848 0.81 FFAR1 (1.00) FFAR1
SCHEMBL12578044 0.81 ALDH1A1 (0.46) FFAR1RAB9ANPC1TDP1ALDH1A1
SCHEMBL2019514 0.80 ALDH1A1 (0.56) FFAR1RAB9ANPC1TDP1ALDH1A1
SCHEMBL1747394 0.80 FFAR1 (0.82) FFAR1

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-7968552-B2 Oxadiazolidinedione compound ASTELLAS PHARMA INC. (JP) 2011-06-28 US disclosed
US-7968552-B2 Oxadiazolidinedione compound ASTELLAS PHARMA INC. (JP) 2011-06-28 US disclosed
US-20090186909-A1 Oxadiazolidinedione Compound ASTELLAS PHARMA INC. (JP) 2009-07-23 US disclosed
US-20090186909-A1 Oxadiazolidinedione Compound ASTELLAS PHARMA INC. (JP) 2009-07-23 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-20090186909-A1 Oxadiazolidinedione Compound GPR119, GPR39, GPR65 FFAR1 64/4885RAB9A 4056/4885NPC1 1958/4885

“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.