SCHEMBL25324020

SCHEMBL25324020

Cn1ncc2c(Br)cnc(Cl)c21.[NaH]

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 1/20 0.33
▸ PI4KA P42356 1/20 0.33
▸ PI4K2B Q8TCG2 1/20 0.33
▸ PI4K2A Q9BTU6 1/20 0.33
▸ PI4KB Q9UBF8 1/20 0.33
▸ CHRNB2 P17787 1/20 0.32
▸ CHRNA4 P43681 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 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
SCHEMBL25320029 0.98 PDE2A (0.33) PDE2API4KAPI4K2BPI4K2API4KB
SCHEMBL25324023 0.95 PDE2A (0.32) PDE2API4KAPI4K2BPI4K2API4KB
SCHEMBL25322907 0.89 PI4KA (0.38) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL25320775 0.76 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL15081232 0.74 ALDH1A1 (0.35) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL25917748 0.74 PDE2A (0.41) PDE2API4KAPI4K2BPI4K2API4KB
SCHEMBL31156165 0.73 SCN9A (0.37) PDE2AALDH1A1LMNAMEN1KMT2A
SCHEMBL22717640 0.73 SCN9A (0.37) PDE2AALDH1A1LMNAMEN1KMT2A
SCHEMBL21979362 0.71 HTT (0.36) PDE2API4KAPI4K2BPI4K2API4KB
SCHEMBL30901316 0.71 HTT (0.36) PDE2API4KAPI4K2BPI4K2API4KB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4469455-A1 COMPOUNDS AND METHODS OF USE Tango Therapeutics, Inc. (US) 2024-12-04 — — EP disclosed
WO-2023146990-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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