SCHEMBL6355159

SCHEMBL6355159

CCOC(=O)CC1CCc2ccccc2O1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.50
SIGMAR1 Q99720 3/20 0.45
HTR1A P08908 3/20 0.45
ADRA2A P08913 1/20 0.45
ADRA2B P18089 1/20 0.45
ADRA2C P18825 1/20 0.45
KCNH2 Q12809 1/20 0.44
GRIN2B Q13224 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.43
GLA P06280 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
HTR1D P28221 1/20 0.43
NOTUM Q6P988 1/20 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
SCHEMBL15219497 0.87 CA2 (0.48) CA2SIGMAR1HTR1AADRA2AADRA2B
SCHEMBL15219465 0.87 CA2 (0.48) CA2SIGMAR1HTR1AADRA2AADRA2B
SCHEMBL8228745 0.86 CA2 (0.52) CA2SIGMAR1HTR1AADRA2AADRA2B
SCHEMBL6954907 0.83 CYP4F2 (0.48) CYP4F2CYP4A11
SCHEMBL10635985 0.83 DRD2 (0.56)
SCHEMBL7981034 0.82 CYP4F2 (0.47) CA2L3MBTL1CYP4F2CYP4A11
SCHEMBL6307386 0.82 CYP4F2 (0.47) CA2L3MBTL1CYP4F2CYP4A11
SCHEMBL6745996 0.82 CYP4F2 (0.47) CA2L3MBTL1CYP4F2CYP4A11
SCHEMBL5640207 0.82 CYP4F2 (0.47) KCNH2GRIN2BL3MBTL1GLACYP4F2
Toluene SCHEMBL6346328 0.81 CYP4F2 (0.43) SIGMAR1CYP4F2CYP4A11

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-6903227-B2 Synthesis of 2-acyl substituted chromanes and intermediates thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-06-07 US disclosed
US-20030233002-A1 Synthesis of 2-Acyl substituted chromanes and intermediates thereof MILLENNIUM PHARMACEUTICALS, INC. 2003-12-18 US disclosed
WO-2001092250-A2 SYNTHESIS OF 2-ACYL SUBSTITUTED CHROMANES AND INTERMEDIATES THEREOF COR THERAPEUTICS, INC. (US) 2001-12-06 WO disclosed
WO-2001087871-A2 METHODS FOR PRODUCING AMINO SUBSTITUTED CHROMANES AND INTERMEDIATES THEREFOR MILLENNIUM PHARMACEUTICALS, INC. (US) 2001-11-22 WO disclosed
US-5925662-A OXIDASE INHIBITORS SYNTHELABO (FR) 1999-07-20 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-20030233002-A1 Synthesis of 2-Acyl substituted chromanes and intermediates thereof PLA2G7, PAFAH1B2, PAFAH1B3 CA2 147/4885SIGMAR1 4662/4885HTR1A 1105/4885

“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.