SCHEMBL15782889

SCHEMBL15782889

Cc1ccc(OCCC(C)(C)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.52
PPARA Q07869 1/20 0.49
DRD2 P14416 6/20 0.48
DRD4 P21917 6/20 0.48
DRD3 P35462 6/20 0.48
NPC1 O15118 1/20 0.45
HRH3 Q9Y5N1 1/20 0.44
WDR5 P61964 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KCNH2 Q12809 2/20 0.42

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
SCHEMBL6255661 0.92 HRH3 (0.49) L3MBTL1PPARAHRH3
SCHEMBL9935752 0.84 LTA4H (0.53) DRD2DRD4DRD3HRH3
SCHEMBL12868339 0.83 DRD2 (0.52) L3MBTL1PPARADRD2DRD4DRD3
SCHEMBL9592060 0.82 SMN1; SMN2 (0.53) NPC1HRH3MEN1KMT2A
SCHEMBL16637914 0.82 ALDH1A1 (0.54) L3MBTL1PPARADRD2DRD4DRD3
SCHEMBL9935748 0.82 HRH3 (0.43) L3MBTL1PPARAHRH3
SCHEMBL18034737 0.82 TDP1 (0.52) L3MBTL1NPC1HRH3KMT2A
SCHEMBL8095513 0.82 KCNA3 (0.54) L3MBTL1PPARA
SCHEMBL21577415 0.80 TP53 (0.45) NPC1MEN1KMT2A
SCHEMBL16745624 0.79 ENPP2 (0.47) PPARAHRH3

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-9597310-B2 Indanyloxydihydrobenzofuranylacetic acids BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-03-21 US disclosed
US-20160235706-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-08-18 US disclosed
US-20140163025-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-06-12 US disclosed
WO-2014086712-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-06-12 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 (2 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-20140163025-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS GPR119, GPBAR1, GPR52 L3MBTL1 4431/4885PPARA 156/4885DRD2 799/4885
US-20160235706-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS GPR119, GPBAR1, GPR52 L3MBTL1 4431/4885PPARA 156/4885DRD2 799/4885

“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.