SCHEMBL29954834

SCHEMBL29954834

Cc1ccc2cc(B(O)O)ccc2n1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.57
POLB P06746 2/20 0.53
KDM4E B2RXH2 2/20 0.53
LMNA P02545 1/20 0.53
CASP6 P55212 1/20 0.53
CA2 P00918 2/20 0.48
CA1 P00915 1/20 0.48
ENPP2 Q13822 2/20 0.44
NPC1 O15118 5/20 0.42
RAB9A P51151 5/20 0.42
TTR P02766 1/20 0.40
LPL P06858 1/20 0.40
LIPG Q9Y5X9 1/20 0.40
KDM1A O60341 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL16738830 1.00 CYP1A2 (0.57) CYP1A2POLBKDM4ELMNACASP6
SCHEMBL16633528 0.89 CYP1A2 (0.57) CYP1A2POLBKDM4ELMNACASP6
SCHEMBL10329143 0.86 CYP1A2 (0.55) CYP1A2POLBKDM4ELMNACASP6
SCHEMBL29952790 0.86 CYP1A2 (0.55) CYP1A2POLBKDM4ELMNACASP6
SCHEMBL29951957 0.78 CA1 (0.50) KDM4ECA2CA1ENPP2TTR
SCHEMBL23797442 0.77 TTR (0.48) CA2CA1ENPP2TTR
SCHEMBL20600767 0.77 CA1 (0.48) CA2CA1ENPP2TTR
SCHEMBL12419233 0.77 CA1 (0.44) POLBKDM4ECA2CA1ENPP2
SCHEMBL14484415 0.75 CYP1A2 (0.42) CYP1A2POLBKDM4ELMNACASP6
SCHEMBL22075308 0.74 CYP1A2 (0.40) CYP1A2POLBKDM4ELMNACASP6

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-2025049746-A1 COMPOSITIONS COMPRISING WERNER SYNDROME HELICASE INHIBITORS AND METHODS OF USING THE SAME EIKON THERAPEUTICS, INC. (US) 2025-03-06 WO disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed