SCHEMBL10108970

SCHEMBL10108970

COc1ccccc1[C@@H]1CCCC[C@@H]1CC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FABP7 O15540 1/20 0.47
FABP3 P05413 1/20 0.47
FABP5 Q01469 1/20 0.47
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
HTR2B P41595 1/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
DRD2 P14416 3/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.45
PIN1 Q13526 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
POLB P06746 1/20 0.42
ATM Q13315 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 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
SCHEMBL10710538 1.00 FABP7 (0.47) FABP7FABP3FABP5HTR2AHTR2C
SCHEMBL317863 1.00 FABP7 (0.47) FABP7FABP3FABP5HTR2AHTR2C
SCHEMBL317304 0.82 HTR2C (0.51) FABP7FABP3FABP5HTR2AHTR2C
SCHEMBL10108951 0.82 HTR2C (0.51) FABP7FABP3FABP5HTR2AHTR2C
SCHEMBL10108965 0.82 HTR2C (0.48) FABP7FABP3FABP5HTR2AHTR2C
SCHEMBL316665 0.82 HTR2C (0.48) FABP7FABP3FABP5HTR2AHTR2C
SCHEMBL10674865 0.82 HTR2C (0.48) FABP7FABP3FABP5HTR2AHTR2C
SCHEMBL10672626 0.82 HTR2A (0.43) FABP7FABP3FABP5HTR2AHTR2C
SCHEMBL10672620 0.82 HTR2A (0.43) FABP7FABP3FABP5HTR2AHTR2C
SCHEMBL319095 0.80 PTGDR2 (0.54) MEN1KMT2APTGDR2ATMALDH1A1

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-8093302-B2 Substituted tetralins as selective estrogen receptor-β agonists ELI LILLY AND COMPANY (US) 2012-01-10 US disclosed
US-8093302-B2 Substituted tetralins as selective estrogen receptor-β agonists ELI LILLY AND COMPANY (US) 2012-01-10 US disclosed
US-20100249075-A1 SUBSTITUTED TETRALINS AS SELECTIVE ESTROGEN RECEPTOR-BETA AGONISTS ELI LILLY AND COMPANY (US) 2010-09-30 US disclosed
US-20100249075-A1 SUBSTITUTED TETRALINS AS SELECTIVE ESTROGEN RECEPTOR-BETA AGONISTS ELI LILLY AND COMPANY (US) 2010-09-30 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-20100249075-A1 SUBSTITUTED TETRALINS AS SELECTIVE ESTROGEN RECEPTOR-BETA AGONISTS ESR2, ERLIN1, ESRRG FABP7 310/4885FABP3 878/4885FABP5 2113/4885

“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.