SCHEMBL8516206

SCHEMBL8516206

Cc1c(CNC(=O)[C@@H]2CCC(=O)N2C(C)C)cccc1C(F)(F)F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 17/20 1.00
KMT2A Q03164 1/20 0.62

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
SCHEMBL8013708 1.00 P2RX7 (1.00) P2RX7KMT2A
SCHEMBL2579502 0.89 P2RX7 (1.00) P2RX7
SCHEMBL2579503 0.89 P2RX7 (1.00) P2RX7
SCHEMBL2578453 0.86 P2RX7 (1.00) P2RX7
SCHEMBL2578459 0.86 P2RX7 (1.00) P2RX7
SCHEMBL3287222 0.84 P2RX7 (1.00) P2RX7KMT2A
SCHEMBL3287224 0.84 P2RX7 (1.00) P2RX7KMT2A
SCHEMBL2582331 0.83 P2RX7 (1.00) P2RX7
SCHEMBL2582324 0.83 P2RX7 (1.00) P2RX7
SCHEMBL3287780 0.81 P2RX7 (1.00) P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049478-B1 SUBSTITUTED N-PHENYLMETHYL -5-OXO-PROLINE-2-AMIDES AS P2X7-RECEPTOR ANTAGONISTS AND THEIR METHODS OF USE GLAXO GROUP LTD (GB) 2012-05-30 EP disclosed