SCHEMBL6426530

SCHEMBL6426530

O=C1N=C(NC23CC4CC(CC2C4)C3)SC1CCNc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 5/20 0.35
CNR2 P34972 2/20 0.33
CNR1 P21554 1/20 0.33
EPHX2 P34913 3/20 0.33
HPGD P15428 1/20 0.32
CCKBR P32239 1/20 0.30

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
SCHEMBL1605496 0.88 EPHX2 (0.37) P2RX7CNR2CNR1EPHX2HPGD
SCHEMBL6504532 0.80 SMN1; SMN2 (0.38) P2RX7EPHX2
SCHEMBL6499906 0.79 P2RX7 (0.52) P2RX7CNR2HPGD
SCHEMBL6506039 0.77 MAPT (0.36) CNR2CNR1EPHX2
SCHEMBL6503448 0.77 SMN1; SMN2 (0.42) P2RX7HPGD
Bromide SCHEMBL6508115 0.75 GLA (0.36) HPGD
SCHEMBL6500205 0.75 DPP9 (0.46) CNR2
SCHEMBL6388648 0.74 P2RX7 (0.50) P2RX7HPGD
SCHEMBL6427832 0.74 ALDH1A1 (0.33)
SCHEMBL6427826 0.72 KMT2A (0.45)

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-20050239853-A1 New compounds BIOVITRUM AB (SE) 2005-10-27 US claimed
US-20050239853-A1 New compounds BIOVITRUM AB (SE) 2005-10-27 US disclosed
WO-2005075471-A2 THIAZOL-COMPOUNDS AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS BIOVITRUM AB (SE) 2005-08-18 WO 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-20050239853-A1 New compounds HSD11B1, CYP11B1, HSD3B1 P2RX7 3883/4885CNR2 1096/4885CNR1 440/4885

“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.