SCHEMBL6502645

SCHEMBL6502645

CCC(=O)C12CC3CC(C1)C(=O)C(C3)C2

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.46
TSHR P16473 4/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD11B1 P28845 5/20 0.39
ALDH1A1 P00352 5/20 0.38
LMNA P02545 2/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
POLB P06746 1/20 0.36
HSP90AA1 P07900 1/20 0.36

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
SCHEMBL1072478 0.82 ALDH1A1 (0.50) TSHRHSD11B1ALDH1A1LMNACYP3A4
SCHEMBL5608278 0.81 LMNA (0.45) EPHX2TSHRNPSR1HSD11B1ALDH1A1
SCHEMBL6496506 0.80 HSD11B1 (0.34) TSHRHSD11B1ALDH1A1LMNACYP3A4
SCHEMBL6495033 0.79 EPHX2 (0.50) EPHX2TSHRNPSR1HSD11B1ALDH1A1
SCHEMBL23815408 0.77 EPHX2 (0.52) EPHX2TSHRNPSR1HSD11B1ALDH1A1
SCHEMBL1847665 0.77 EPHX2 (0.52) EPHX2TSHRNPSR1HSD11B1ALDH1A1
SCHEMBL328950 0.77 EPHX2 (0.52) EPHX2TSHRNPSR1HSD11B1ALDH1A1
SCHEMBL1847669 0.77 EPHX2 (0.52) EPHX2TSHRNPSR1HSD11B1ALDH1A1
SCHEMBL1398388 0.77 EPHX2 (0.52) EPHX2TSHRNPSR1HSD11B1ALDH1A1
SCHEMBL1847663 0.77 EPHX2 (0.52) EPHX2TSHRNPSR1HSD11B1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6949615-B2 Monomer having electron-withdrawing group and process for preparing the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2005-09-27 US disclosed
EP-1331216-A1 MONOMERS HAVING ELECTRON-WITHDRAWING GROUPS AND PROCESSES FOR PREPARING THE SAME Daicel Chemical Industries, Ltd. (JP) 2003-07-30 EP disclosed
US-20030059710-A1 Monomer having electron-withdrawing group and process for preparing the same DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-03-27 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-20030059710-A1 Monomer having electron-withdrawing group and process for preparing the same RFC3, RFC2, MAPRE1 EPHX2 1930/4885TSHR 783/4885NPSR1 1335/4885

“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.