SCHEMBL29330566

SCHEMBL29330566

N#Cc1cc(OCc2ccccc2)cc(Nc2ccc3c(F)c[nH]c3c2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.50
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
MDH2 P40926 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
NSD2 O96028 1/20 0.37
AS3MT Q9HBK9 1/20 0.37
LTA4H P09960 1/20 0.37
PLA2G2A P14555 1/20 0.37
MAOB P27338 2/20 0.37
CTSV O60911 2/20 0.37
CTSL P07711 2/20 0.37
EGFR P00533 1/20 0.37
TTBK1 Q5TCY1 1/20 0.37
TTBK2 Q6IQ55 1/20 0.37
AURKB Q96GD4 1/20 0.37
CDC7 O00311 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
SCHEMBL29330495 0.89 IMPDH2 (0.38) IMPDH2MAOBEGFRMETAR
SCHEMBL29330842 0.89 IMPDH2 (0.36) IMPDH2HPGDKDM4ELTA4HPLA2G2A
SCHEMBL30938624 0.86 CSNK1A1 (0.41) IMPDH2HPGDSMN1; SMN2TRPM8TTBK1
SCHEMBL29330958 0.86 CSNK1A1 (0.41) IMPDH2HPGDSMN1; SMN2TRPM8TTBK1
SCHEMBL29331093 0.85 KDM4E (0.35) IMPDH2ALDH1A1HPGDKDM4EMAPT
SCHEMBL29331089 0.83 MET (0.37) IMPDH2MET
SCHEMBL29330430 0.82 PRKCQ (0.43) IMPDH2ALDH1A1HPGDMAPTNSD2
SCHEMBL29330496 0.82 GAA (0.34) HPGDKDM4EMAPTEGFRTTBK1
SCHEMBL30938599 0.82 APP (0.33) IMPDH2HPGDKDM4EMAPTMET
SCHEMBL29330570 0.81 APP (0.36) MET

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-2024151919-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2024-07-18 WO disclosed