SCHEMBL9254151

SCHEMBL9254151

CCCCC(=O)C(=Cc1ccc(Br)cc1)C(=O)OC

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
LMNA P02545 3/20 0.55
NPSR1 Q6W5P4 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
S1PR4 O95977 1/20 0.55
S1PR1 P21453 1/20 0.55
MAPK1 P28482 1/20 0.55
HPGD P15428 1/20 0.44
ATM Q13315 2/20 0.44
XBP1 P17861 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GPR183 P32249 2/20 0.41
PTGS2 P35354 1/20 0.41
RAB9A P51151 1/20 0.41
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL9254147 1.00 MAPT (0.55) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL9567682 0.84 LMNA (0.51) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL9567685 0.84 LMNA (0.51) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL2812581 0.82 MAPT (0.67) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL10353050 0.77 MAPT (0.57) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL28091426 0.77 MAPT (0.57) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL430650 0.74 NR1H4 (0.50) SMN1; SMN2KDM4ECYP1A2
SCHEMBL6740629 0.73 KMT2A (0.51) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL30973302 0.73 KMT2A (0.51) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL6740625 0.73 KMT2A (0.51) MAPTLMNANPSR1MEN1KMT2A

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
US-5430149-A 5-[(4-bromophenyl)methyl]4-pyrimidinones SYNTHELABO (FR) 1995-07-04 US disclosed
US-5312920-A Process for preparing 4-pyrimidinones SYNTHELABO (FR) 1994-05-17 US disclosed