SCHEMBL5848091

SCHEMBL5848091

COC(=O)[C@@H]1CCc2ccccc2O1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
HDAC3 O15379 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
HSD11B1 P28845 1/20 0.45
SSTR4 P31391 1/20 0.43
CA2 P00918 2/20 0.43
KMT2A Q03164 2/20 0.42
CYP2D6 P10635 2/20 0.42
OPRK1 P41145 2/20 0.42
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 1/20 0.40
ATM Q13315 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
SCHEMBL5848088 1.00 CYP4F2 (0.47) CYP4F2CYP4A11HDAC3HDAC1HDAC2
SCHEMBL4926783 1.00 CYP4F2 (0.47) CYP4F2CYP4A11HDAC3HDAC1HDAC2
SCHEMBL29588217 1.00 CYP4F2 (0.47) CYP4F2CYP4A11HDAC3HDAC1HDAC2
SCHEMBL5846876 0.84 HPGD (0.54) HDAC3HDAC1HDAC2NFKB1NFKB2
SCHEMBL5846867 0.84 HPGD (0.54) HDAC3HDAC1HDAC2NFKB1NFKB2
SCHEMBL3519014 0.84 HPGD (0.54) HDAC3HDAC1HDAC2NFKB1NFKB2
SCHEMBL7636320 0.84 CYP4F2 (0.67) CYP4F2CYP4A11HSD11B1CA2KMT2A
SCHEMBL30783522 0.84 HSD11B1 (0.45) CYP4F2CYP4A11HDAC3HDAC1HDAC2
SCHEMBL9739640 0.84 CYP4F2 (0.67) CYP4F2CYP4A11HSD11B1CA2KMT2A
Fluoride SCHEMBL30783511 0.82 HSD11B1 (0.44) CYP4F2CYP4A11HDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240051931-A1 HDAC INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2024-02-15 US disclosed
WO-2022120048-A1 HDAC INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2022-06-09 WO disclosed
WO-2022120048-A1 HDAC INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2022-06-09 WO disclosed
EP-2817299-B1 SUBSTITUTED CHROMAN COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LTD (IN) 2019-06-12 EP disclosed
US-9987249-B2 Substituted chroman compounds as calcium sensing receptor modulators LUPIN LIMITED (IN) 2018-06-05 US disclosed
US-9987249-B2 Substituted chroman compounds as calcium sensing receptor modulators LUPIN LIMITED (IN) 2018-06-05 US disclosed
US-20170209410-A1 SUBSTITUTED CHROMAN COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LIMITED (IN) 2017-07-27 US disclosed
US-20170209410-A1 SUBSTITUTED CHROMAN COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LIMITED (IN) 2017-07-27 US disclosed
US-9598391-B2 Substituted chroman compounds as calcium sensing receptor modulators LUPIN ATLANTIS HOLDINGS SA (CH) 2017-03-21 US disclosed
US-9598391-B2 Substituted chroman compounds as calcium sensing receptor modulators LUPIN ATLANTIS HOLDINGS SA (CH) 2017-03-21 US disclosed
US-20150368222-A1 SUBSTITUTED CHROMAN COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LIMITED (IN) 2015-12-24 US disclosed
US-20150368222-A1 SUBSTITUTED CHROMAN COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LIMITED (IN) 2015-12-24 US disclosed
US-9163001-B2 Substituted chroman compounds as calcium sensing receptor modulators LUPIN LIMITED (IN) 2015-10-20 US disclosed
US-9163001-B2 Substituted chroman compounds as calcium sensing receptor modulators LUPIN LIMITED (IN) 2015-10-20 US disclosed
US-20150038546-A1 SUBSTITUTED CHROMAN COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LIMITED (IN) 2015-02-05 US disclosed
US-20150038546-A1 SUBSTITUTED CHROMAN COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LIMITED (IN) 2015-02-05 US disclosed
WO-2013124828-A1 SUBSTITUTED CHROMAN COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS LUPIN LIMITED (IN) 2013-08-29 WO disclosed
US-7034051-B2 Fused bicyclic carboxamide derivatives and methods of their use ADOLOR CORPORATION (US) 2006-04-25 US disclosed
WO-2005023799-A1 FUSED BICYCLIC CARBOXAMIDE DERIVATIVES AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2005-03-17 WO disclosed
US-20050054630-A1 Fused bicyclic carboxamide derivatives and methods of their use CUBIST PHARMACEUTICALS, INC. 2005-03-10 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 (5 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-20150368222-A1 SUBSTITUTED CHROMAN COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS CASR, RYR2, CALCR CYP4F2 3208/4885CYP4A11 902/4885HDAC3 1716/4885
US-20240051931-A1 HDAC INHIBITORS HDAC8, HDAC1, HDAC2 CYP4F2 4724/4885CYP4A11 3805/4885HDAC3 4/4885
US-20170209410-A1 SUBSTITUTED CHROMAN COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS CASR, RYR2, CALCR CYP4F2 3208/4885CYP4A11 902/4885HDAC3 1716/4885
US-20150038546-A1 SUBSTITUTED CHROMAN COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS CASR, RYR2, CALCR CYP4F2 3208/4885CYP4A11 902/4885HDAC3 1716/4885
US-20050054630-A1 Fused bicyclic carboxamide derivatives and methods of their use PAICS, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CPS1 CYP4F2 367/4885CYP4A11 742/4885HDAC3 19/4885

“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.