SCHEMBL11034748

SCHEMBL11034748

CC(Oc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.61
MEN1 O00255 3/20 0.61
RXFP1 Q9HBX9 1/20 0.61
POLB P06746 2/20 0.60
LMNA P02545 4/20 0.58
MAPT P10636 4/20 0.58
KDM4E B2RXH2 1/20 0.58
PKM P14618 1/20 0.58
MAPK1 P28482 1/20 0.58
RAB9A P51151 1/20 0.58
IL18 Q14116 1/20 0.58
FNTA P49354 1/20 0.54
FNTB P49356 1/20 0.54
TSHR P16473 1/20 0.53
HTT P42858 2/20 0.52
ATM Q13315 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 4/20 0.51
HPGD P15428 4/20 0.51
CRHBP P24387 2/20 0.51

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
SCHEMBL10822989 0.96 LMNA (0.56) KMT2AMEN1RXFP1POLBLMNA
SCHEMBL10822517 0.95 LMNA (0.64) KMT2AMEN1RXFP1POLBLMNA
SCHEMBL10822750 0.90 LMNA (0.58) KMT2AMEN1RXFP1POLBLMNA
SCHEMBL10823098 0.90 MEN1 (0.59) KMT2AMEN1RXFP1POLBLMNA
SCHEMBL10822946 0.89 MEN1 (0.57) KMT2AMEN1RXFP1POLBLMNA
SCHEMBL10822649 0.89 LMNA (0.58) KMT2AMEN1RXFP1POLBLMNA
SCHEMBL10822481 0.87 MEN1 (0.54) KMT2AMEN1RXFP1POLBLMNA
SCHEMBL10822431 0.86 LMNA (0.65) KMT2AMEN1POLBLMNAMAPT
SCHEMBL10822535 0.86 ALDH1A1 (0.61) KMT2AMEN1RXFP1POLBLMNA
SCHEMBL10822767 0.85 ALDH1A1 (0.74) KMT2AMEN1LMNAMAPTKDM4E

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
JP-59116255-A None JP disclosed
JP-S59116255-A SELECTIVE HERBICIDE KANESHO KK 1984-07-05 JP disclosed