SCHEMBL26345510

SCHEMBL26345510

CC(C)n1c(=O)nc(NCc2cc3c(cc2F)CCO3)[nH]c1=O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PDE9A O76083 3/20 0.34
▸ P2RX3 P56373 3/20 0.33
▸ P2RX7 Q99572 2/20 0.32
▸ NPY5R Q15761 2/20 0.32
▸ MMP13 P45452 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
SCHEMBL26344125 0.82 PDE9A (0.45) PDE9AP2RX3
SCHEMBL31207897 0.81 IDH1 (0.34) P2RX3P2RX7
SCHEMBL26344146 0.81 IDH1 (0.34) P2RX3P2RX7
SCHEMBL30459380 0.81 IDH1 (0.34) P2RX3P2RX7
SCHEMBL26344164 0.76 MEN1 (0.39) PDE9AP2RX3
SCHEMBL26344898 0.75 MTOR (0.38) PDE9AP2RX3
SCHEMBL26345271 0.74 CASR (0.36) PDE9AP2RX3
SCHEMBL26344022 0.73 PDE9A (0.46) PDE9A
SCHEMBL31364128 0.73 OGA (0.39) PDE9A
SCHEMBL26344128 0.73 OGA (0.39) PDE9A

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-4249474-A1 TRIAZINE DIONE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF IN MEDICINE Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) 2023-09-27 — — EP disclosed
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