SCHEMBL29403157

SCHEMBL29403157

O=C(Oc1ccc2ccccc2n1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.53
MAPT P10636 4/20 0.53
CNR2 P34972 2/20 0.53
MEN1 O00255 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
SMN1; SMN2 Q16637 4/20 0.50
KDM4E B2RXH2 4/20 0.50
LMNA P02545 3/20 0.49
METAP2 P50579 1/20 0.49
METAP1 P53582 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 1/20 0.49
MGAM O43451 1/20 0.49
HPGD P15428 1/20 0.44
F2 P00734 1/20 0.44
GPBAR1 Q8TDU6 2/20 0.43
CYSLTR1 Q9Y271 1/20 0.43
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41

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
SCHEMBL7773905 1.00 KMT2A (0.53) KMT2AMAPTCNR2MEN1TDP1
SCHEMBL2762995 0.98 KMT2A (0.51) KMT2AMAPTCNR2MEN1TDP1
SCHEMBL294784 0.84 MGAM (0.53) KMT2AMAPTCNR2MEN1SMN1; SMN2
SCHEMBL26038534 0.83 KMT2A (0.67) KMT2AMAPTMEN1TDP1
SCHEMBL6945665 0.82 MGAM (0.47) KMT2AMAPTCNR2MEN1SMN1; SMN2
SCHEMBL9033949 0.79 MGAM (0.47) KMT2AMAPTCNR2MEN1SMN1; SMN2
SCHEMBL31140011 0.79 MGAM (0.47) KMT2AMAPTCNR2MEN1SMN1; SMN2
SCHEMBL2316635 0.79 MGAM (0.47) KMT2AMAPTCNR2MEN1SMN1; SMN2
SCHEMBL4266167 0.79 MAPT (0.49) KMT2AMAPTCNR2MEN1TDP1
SCHEMBL16449537 0.78 KMT2A (0.48) KMT2AMAPTCNR2MEN1SMN1; 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
CN-114173727-A Antimicrobial device for insertion needle 3M创新有限公司 2022-03-11 CN disclosed