SCHEMBL29700587

SCHEMBL29700587

Cc1nccn1Cc1ccc(Br)nc1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
CYP11B1 P15538 1/20 0.53
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
HTR1A P08908 1/20 0.41
HTR2C P28335 1/20 0.41
GRM2 Q14416 1/20 0.40
KCNH2 Q12809 3/20 0.39
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37

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
SCHEMBL23121198 1.00 LMNA (0.68) LMNAL3MBTL1CYP11B1ALDH1A1POLB
SCHEMBL31270697 0.82 LMNA (0.74) LMNAL3MBTL1ALDH1A1POLBKMT2A
SCHEMBL17102309 0.81 LMNA (0.64) LMNAL3MBTL1CYP11B1ALDH1A1POLB
SCHEMBL169675 0.78 LMNA (0.68) LMNAL3MBTL1CYP11B1ALDH1A1POLB
SCHEMBL31729500 0.78 LMNA (0.68) LMNAL3MBTL1ALDH1A1POLBKMT2A
SCHEMBL26127200 0.76 LMNA (0.54) LMNAL3MBTL1ALDH1A1POLBKMT2A
SCHEMBL2950629 0.76 LMNA (0.71) LMNAL3MBTL1ALDH1A1POLBKMT2A
SCHEMBL301107 0.76 LMNA (0.66) LMNAL3MBTL1ALDH1A1POLBKMT2A
SCHEMBL22180828 0.75 LMNA (0.60) LMNAL3MBTL1CYP11B1ALDH1A1CHRNB2
SCHEMBL277927 0.75 LMNA (0.64) LMNAL3MBTL1CYP11B1ALDH1A1POLB

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
EP-4031240-A1 NEW COMPOUNDS Vicore Pharma AB (SE) 2022-07-27 EP disclosed
CN-114786774-A Novel compounds 维科尔药物公司 2022-07-22 CN disclosed