SCHEMBL15782885

SCHEMBL15782885

Cc1cccc(CCCC(C)(C)O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.52
FDPS P14324 1/20 0.51
HSP90AA1 P07900 1/20 0.46
HSP90AB1 P08238 1/20 0.46
HMGCR P04035 1/20 0.45
HRH3 Q9Y5N1 1/20 0.44
DAO P14920 1/20 0.42
IDO1 P14902 2/20 0.42
SLC5A2 P31639 1/20 0.42
GRM2 Q14416 1/20 0.42
GRM3 Q14832 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
GPR84 Q9NQS5 1/20 0.41
POLB P06746 2/20 0.41
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40

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
SCHEMBL15813127 0.89 TAAR1 (0.55) TAAR1FDPSHRH3DAOIDO1
SCHEMBL12215696 0.82 TAAR1 (0.56) TAAR1FDPSHSP90AA1HSP90AB1HRH3
SCHEMBL18201577 0.81 MAOB (0.52) HMGCRGRM2GRM3
SCHEMBL6292536 0.81 TAAR1 (0.50) TAAR1HMGCRIDO1
SCHEMBL8099771 0.80 TAAR1 (0.68) TAAR1FDPSHRH3DAOIDO1
SCHEMBL8092500 0.80 TAAR1 (0.68) TAAR1FDPSHRH3DAOIDO1
SCHEMBL3804525 0.79 POLB (0.49) FDPSPOLBHDAC3HDAC1HDAC2
SCHEMBL8094389 0.78 TAAR1 (0.65) TAAR1FDPSHRH3DAOIDO1
SCHEMBL8101532 0.78 TAAR1 (0.65) TAAR1FDPSHRH3DAOIDO1
SCHEMBL8086943 0.78 TAAR1 (0.65) TAAR1FDPSHRH3DAOIDO1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140163025-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-06-12 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-20140163025-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS GPR119, GPBAR1, GPR52 TAAR1 138/4885FDPS 1463/4885HSP90AA1 764/4885

“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.