SCHEMBL9775481

SCHEMBL9775481

C(=NN(c1ccccc1)c1cccc2ccccc12)c1ccc(N(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.45
ALDH1A1 P00352 6/20 0.45
MEN1 O00255 5/20 0.45
MCL1 Q07820 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
G6PC1 P35575 6/20 0.44
MAPT P10636 8/20 0.43
GAA P10253 2/20 0.43
HSP90AA1 P07900 1/20 0.43
LMNA P02545 6/20 0.41
KDM4E B2RXH2 4/20 0.41
MAPK1 P28482 4/20 0.41
HPGD P15428 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
MITF O75030 1/20 0.41
RAD52 P43351 1/20 0.41
CYP2C19 P33261 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
TSHR P16473 1/20 0.37
ATM Q13315 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
SCHEMBL9775478 1.00 KMT2A (0.45) KMT2AALDH1A1MEN1MCL1SMN1; SMN2
SCHEMBL5921965 0.86 MAPT (0.46) KMT2AALDH1A1MEN1MCL1SMN1; SMN2
SCHEMBL5921967 0.86 MAPT (0.46) KMT2AALDH1A1MEN1MCL1SMN1; SMN2
SCHEMBL6260832 0.85 MAPT (0.48) KMT2AALDH1A1MEN1MCL1SMN1; SMN2
SCHEMBL16745300 0.84 APP (0.38) KMT2AALDH1A1MEN1MCL1SMN1; SMN2
SCHEMBL170198 0.84 ALDH1A1 (0.56) KMT2AALDH1A1MEN1MCL1SMN1; SMN2
SCHEMBL332653 0.84 ALDH1A1 (0.56) KMT2AALDH1A1MEN1MCL1SMN1; SMN2
SCHEMBL13855340 0.82 SIGMAR1 (0.43) KMT2AALDH1A1MEN1MCL1SMN1; SMN2
SCHEMBL9775460 0.82 ALDH1A1 (0.49) KMT2AALDH1A1MEN1MCL1SMN1; SMN2
SCHEMBL9775459 0.82 ALDH1A1 (0.49) KMT2AALDH1A1MEN1MCL1SMN1; SMN2

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
US-4990625-A Process for synthesis of N,N-disubstituted hydrazone CANON KABUSHIKI KAISHA (JP) 1991-02-05 US disclosed