SCHEMBL26818363

SCHEMBL26818363

CC(C)c1ccnc(N2CCC(C(C)C)CC2)n1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 7/20 0.56
▸ SORD Q00796 2/20 0.42
▸ NR1H2 P55055 1/20 0.42
▸ NR1H3 Q13133 1/20 0.42
▸ DKK1 O94907 2/20 0.39
▸ HRH4 Q9H3N8 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ HTR3A P46098 1/20 0.36
▸ EGFR P00533 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ RBP4 P02753 1/20 0.35
▸ PANK3 Q9H999 1/20 0.35

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
SCHEMBL13384572 0.86 ACHE (0.53) ACHESORDNR1H2NR1H3DKK1
SCHEMBL24126288 0.83 ACHE (0.57) ACHESORDKDM4EALDH1A1HPGD
SCHEMBL15341840 0.82 DYRK1A (0.43) ACHESORDNR1H2NR1H3DKK1
SCHEMBL26141097 0.82 SORD (0.47) ACHESORDNR1H2NR1H3KDM4E
SCHEMBL13384562 0.82 SORD (0.47) ACHESORDNR1H2NR1H3CDK2
SCHEMBL13384586 0.81 SORD (0.46) ACHESORDNR1H2NR1H3ALDH1A1
SCHEMBL26684341 0.81 ACHE (0.55) ACHESORDDKK1KDM4EALDH1A1
SCHEMBL15341852 0.81 ACHE (0.47) ACHESORDNR1H2NR1H3
SCHEMBL26141083 0.81 DYRK1A (0.49) ACHESORDNR1H2NR1H3HRH4
SCHEMBL17148516 0.81 DYRK1A (0.47) ACHESORDNR1H2NR1H3DKK1

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
WO-2023220134-A1 PYRAZINE DERIVATIVES AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2023-11-16 — — WO disclosed
WO-2023220137-A1 PYRAZINE DERIVATIVES AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2023-11-16 — — WO disclosed
WO-2023220129-A1 BENZOYPARAZINE PYRAZINES ANE THEIR USES FOGHORN THERAPEUTICS INC. (US) 2023-11-16 — — WO disclosed
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