SCHEMBL9268258

SCHEMBL9268258

CNC(=O)Nc1ccccc1-c1ccc(CO)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.58
RECQL P46063 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
LMNA P02545 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
GAA P10253 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAPT P10636 3/20 0.47
HTT P42858 2/20 0.47
KDM4E B2RXH2 1/20 0.47
KCNQ2 O43526 1/20 0.47
SOAT1 P35610 2/20 0.43
NTRK1 P04629 1/20 0.43
TSHR P16473 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42

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
SCHEMBL12051678 0.85 ALDH1A1 (0.68) ALDH1A1RECQLSMN1; SMN2L3MBTL1MEN1
SCHEMBL7785749 0.81 CHRM3 (0.48) ALDH1A1LMNAL3MBTL1MEN1KMT2A
SCHEMBL7795981 0.80 FABP4 (0.50) ALDH1A1LMNAL3MBTL1MEN1KMT2A
SCHEMBL9251204 0.78 POLB (0.43) ALDH1A1RECQLSMN1; SMN2LMNAMEN1
SCHEMBL7791770 0.76 GHSR (0.47) SMN1; SMN2
SCHEMBL14003501 0.75 ALDH1A1 (1.00) ALDH1A1RECQLSMN1; SMN2MEN1KMT2A
SCHEMBL16919653 0.74 ALDH1A1 (0.60) ALDH1A1RECQLSMN1; SMN2MEN1KMT2A
SCHEMBL5105758 0.74 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2LMNAL3MBTL1MEN1
SCHEMBL34420050 0.74 CA12 (0.64) ALDH1A1L3MBTL1MEN1KMT2AMAPT
SCHEMBL7791555 0.74 MTNR1A (0.55) MAPTHDAC3HDAC1HDAC2HDAC6

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
WO-1995016675-A1 BENZO-FUSED LACTAMS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1995-06-22 WO disclosed