SCHEMBL29619417

SCHEMBL29619417

Oc1ccccc1-c1cc2c(C3CCNCC3)c[nH]c2nn1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 5/20 0.48
▸ HTR2C P28335 2/20 0.46
▸ ADRB2 P07550 1/20 0.46
▸ SMARCA2 P51531 3/20 0.44
▸ SMARCA4 P51532 3/20 0.44
▸ PBRM1 Q86U86 3/20 0.44
▸ CHUK O15111 2/20 0.42
▸ APP P05067 4/20 0.40
▸ CHEK2 O96017 3/20 0.38
▸ CAMKK2 Q96RR4 1/20 0.38
▸ GABRA1 P14867 1/20 0.37
▸ GABRB2 P47870 1/20 0.37
▸ CHEK1 O14757 1/20 0.37
▸ BRD4 O60885 1/20 0.36
▸ NR1I2 O75469 1/20 0.36

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
SCHEMBL22777062 1.00 IKBKB (0.48) IKBKBHTR2CADRB2SMARCA2SMARCA4
SCHEMBL24461294 0.93 IKBKB (0.44) IKBKBHTR2CADRB2SMARCA2SMARCA4
SCHEMBL30552534 0.88 PBRM1 (0.40) IKBKBSMARCA2SMARCA4PBRM1CHUK
SCHEMBL24461290 0.88 PBRM1 (0.40) IKBKBSMARCA2SMARCA4PBRM1CHUK
SCHEMBL22777840 0.87 PBRM1 (0.39) IKBKBHTR2CADRB2SMARCA2SMARCA4
SCHEMBL22790943 0.86 CYP1A2 (0.49) SMARCA2SMARCA4PBRM1APP
SCHEMBL22791037 0.86 PBRM1 (0.40) IKBKBHTR2CADRB2SMARCA2SMARCA4
SCHEMBL24461315 0.83 KDM4E (0.39) IKBKBSMARCA2SMARCA4PBRM1CHEK2
SCHEMBL25467865 0.83 PBRM1 (0.40) IKBKBSMARCA2SMARCA4PBRM1CHUK
SCHEMBL27052473 0.83 PBRM1 (0.39) IKBKBSMARCA2SMARCA4PBRM1CHUK

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-2022109426-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2022-05-27 — — WO disclosed
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