SCHEMBL6769372

SCHEMBL6769372

COC(=O)[C@@H]1CC(Oc2ccc(Br)cc2)CN1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 1/20 0.46
HRH3 Q9Y5N1 10/20 0.42
PIM1 P11309 1/20 0.40
KCNH2 Q12809 6/20 0.39
EPHX2 P34913 1/20 0.39

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
SCHEMBL6769375 1.00 P2RX3 (0.46) P2RX3HRH3PIM1KCNH2EPHX2
SCHEMBL29523978 0.87 HRH3 (0.53) P2RX3HRH3PIM1KCNH2EPHX2
SCHEMBL27483408 0.86 P2RX3 (0.57) P2RX3HRH3PIM1KCNH2
SCHEMBL8342318 0.86 P2RX3 (0.57) P2RX3HRH3PIM1KCNH2
SCHEMBL29523531 0.86 HRH3 (0.52) P2RX3HRH3PIM1KCNH2EPHX2
SCHEMBL12442660 0.86 HRH3 (0.52) P2RX3HRH3PIM1KCNH2EPHX2
SCHEMBL23260557 0.86 HRH3 (0.50) P2RX3HRH3PIM1
SCHEMBL3961763 0.86 HRH3 (0.50) P2RX3HRH3PIM1
SCHEMBL951361 0.86 HRH3 (0.50) P2RX3HRH3PIM1
SCHEMBL950955 0.86 HRH3 (0.50) P2RX3HRH3PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6710064-B2 FOR THERAPY OF INFLAMMATORY OR IMMUNE DISEASES BRISTOL-MYERS SQUIBB CO. 2004-03-23 US disclosed
EP-1339718-A1 HYDANTOIN COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS Bristol-Myers Squibb Company (US) 2003-09-03 EP disclosed
US-20020143035-A1 Hydantoin compounds useful as anti-inflammatory agents BRISTOL-MYERS SQUIBB COMPANY 2002-10-03 US disclosed
WO-2002044181-A1 HYDANTOIN COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-06-06 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-20020143035-A1 Hydantoin compounds useful as anti-inflammatory agents HRH4, IL4I1, HRH2 P2RX3 1304/4885HRH3 8/4885PIM1 3763/4885

“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.