SCHEMBL24693472

SCHEMBL24693472

CSc1nc2cc(Br)nn2c(=O)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.37
▸ PKM P14618 1/20 0.36
▸ CSNK2A2 P19784 1/20 0.34
▸ CSNK2B P67870 1/20 0.34
▸ CSNK2A1 P68400 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HAVCR2 Q8TDQ0 1/20 0.34
▸ POLB P06746 1/20 0.33

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
SCHEMBL18788152 0.84 USP2 (0.57) USP2TSHRALDH1A1PKMKDM4E
SCHEMBL5457663 0.78 NPC1 (0.52) ALDH1A1KDM4EMAPTPOLB
SCHEMBL18788145 0.76 GRM2 (0.46) TSHRALDH1A1KDM4EMAPTPOLB
SCHEMBL23998512 0.73 ADORA3 (0.51) ALDH1A1
SCHEMBL20541989 0.70 LMNA (0.38) ALDH1A1CSNK2A2CSNK2BCSNK2A1
SCHEMBL17926551 0.66 LMNA (0.40) TSHRALDH1A1PKMKDM4EMAPT
SCHEMBL18788176 0.65 LMNA (0.44) KDM4EMAPT
SCHEMBL20449592 0.65 KMT2A (0.36) ALDH1A1PKMKDM4EPOLB
SCHEMBL18788165 0.64 LMNA (0.38) —
SCHEMBL31404515 0.64 LMNA (0.38) PKM

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
WO-2022256300-A1 FUSED BICYCLIC HETEROCYCLIC COMPOUNDS AND USES THEREOF Verge Analytics, Inc. (US) 2022-12-08 — — WO disclosed
WO-2022256300-A1 FUSED BICYCLIC HETEROCYCLIC COMPOUNDS AND USES THEREOF Verge Analytics, Inc. (US) 2022-12-08 — — WO disclosed
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