SCHEMBL26653887

SCHEMBL26653887

O=C(O)N1CCC(c2cc3nnc(-c4ccccc4O)cc3n2C2CC2)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PBRM1 Q86U86 15/20 0.37
▸ SMARCA2 P51531 11/20 0.37
▸ SMARCA4 P51532 11/20 0.37
▸ NR1I2 O75469 7/20 0.36
▸ NR1H2 P55055 3/20 0.36
▸ NPC1 O15118 3/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ HPGD P15428 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ NR1H3 Q13133 2/20 0.35
▸ SCD5 Q86SK9 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34

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
SCHEMBL26653880 1.00 PBRM1 (0.37) PBRM1SMARCA2SMARCA4NR1I2NR1H2
SCHEMBL26653899 1.00 PBRM1 (0.37) PBRM1SMARCA2SMARCA4NR1I2NR1H2
SCHEMBL30658053 0.86 SMARCA2 (0.51) PBRM1SMARCA2SMARCA4SMN1; SMN2BRD4
SCHEMBL26654155 0.86 SMARCA2 (0.51) PBRM1SMARCA2SMARCA4SMN1; SMN2BRD4
SCHEMBL30657990 0.86 SMARCA2 (0.51) PBRM1SMARCA2SMARCA4SMN1; SMN2BRD4
SCHEMBL26654143 0.82 SMARCA2 (0.53) PBRM1SMARCA2SMARCA4SMN1; SMN2MAPT
SCHEMBL26654239 0.79 PBRM1 (0.42) PBRM1SMARCA2SMARCA4NR1I2NR1H2
SCHEMBL26653968 0.77 IKBKB (0.39) PBRM1SMARCA2SMARCA4NR1I2NR1H2
SCHEMBL26654141 0.77 IKBKB (0.39) PBRM1SMARCA2SMARCA4NR1I2NR1H2
SCHEMBL26654149 0.77 IKBKB (0.39) PBRM1SMARCA2SMARCA4NR1I2NR1H2

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
WO-2023220134-A1 PYRAZINE DERIVATIVES AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2023-11-16 — — WO disclosed
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