SCHEMBL7740953

SCHEMBL7740953

COC(=O)c1ccc(CO/N=C2/C(=O)N(CC(=O)O)c3ccccc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
MAPT P10636 4/20 0.45
POLB P06746 2/20 0.45
LMNA P02545 2/20 0.45
KMT2A Q03164 3/20 0.45
HPGD P15428 2/20 0.45
F2 P00734 1/20 0.45
ATM Q13315 1/20 0.45
HSP90AA1 P07900 1/20 0.44
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44
TUBB3 Q13509 1/20 0.44
TUBB2A Q13885 1/20 0.44
TUBB8 Q3ZCM7 1/20 0.44
TUBA3E Q6PEY2 1/20 0.44
TUBA1A Q71U36 1/20 0.44

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
SCHEMBL7745479 0.91 ALDH1A1 (0.47) ALDH1A1MAPTPOLBLMNAKMT2A
SCHEMBL7745310 0.87 POLB (0.45) ALDH1A1MAPTPOLBLMNAKMT2A
SCHEMBL7746032 0.86 FFAR4 (0.39) MAPTLMNAKMT2AMEN1
SCHEMBL7745904 0.75 DRD2 (0.44) ALDH1A1MAPTPOLBLMNAHPGD
SCHEMBL7741406 0.75 DRD2 (0.44) ALDH1A1MAPTPOLBLMNANPSR1
SCHEMBL7740752 0.75 DRD2 (0.44) ALDH1A1MAPTPOLBLMNA
SCHEMBL25706953 0.71 KMT2A (0.58) ALDH1A1MAPTPOLBLMNAKMT2A
SCHEMBL281270 0.70 CES1 (0.63) ALDH1A1MAPT
SCHEMBL7615847 0.70 KMT2A (0.49) ALDH1A1MAPTPOLBLMNAKMT2A
SCHEMBL7615845 0.70 KMT2A (0.49) ALDH1A1MAPTPOLBLMNAKMT2A

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-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed