SCHEMBL6501809

SCHEMBL6501809

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

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.41
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KMT2A Q03164 4/20 0.35
MEN1 O00255 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
HDAC6 Q9UBN7 2/20 0.32
IDO1 P14902 1/20 0.32
ALDH1A1 P00352 2/20 0.31
VDR P11473 1/20 0.31
NPC1 O15118 1/20 0.31
DPP4 P27487 1/20 0.31
SLC22A2 O15244 1/20 0.31
SLC47A1 Q96FL8 1/20 0.31

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
SCHEMBL2965277 0.81 KMT2A (0.47) EPHX2KMT2AMEN1SMN1; SMN2IDO1
SCHEMBL6496572 0.81 KMT2A (0.33) KMT2AMEN1
SCHEMBL6492766 0.80 EPHX2 (0.44) EPHX2TSHRNPSR1KMT2AMEN1
Ammonia Solution, Strong SCHEMBL11633437 0.79 KMT2A (0.46) EPHX2KMT2AMEN1SMN1; SMN2IDO1
SCHEMBL3433888 0.67 EPHX2 (0.36) EPHX2TSHRNPSR1
SCHEMBL6502645 0.67 EPHX2 (0.46) EPHX2TSHRNPSR1ALDH1A1
SCHEMBL12430198 0.66 NPSR1 (0.51) EPHX2TSHRNPSR1KMT2AMEN1
SCHEMBL10158506 0.66 EPHX2 (0.36) EPHX2TSHRNPSR1
SCHEMBL26598035 0.66 CYP17A1 (0.43) EPHX2TSHRNPSR1KMT2AMEN1
SCHEMBL26849803 0.66 MEN1 (0.41) EPHX2TSHRNPSR1KMT2AMEN1

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.