SCHEMBL9519617

SCHEMBL9519617

CCc1cc(=O)n(-c2cc(C(=O)OC(C)C)c(Cl)cc2F)c(=O)n1C(F)F

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
PPOX P50336 1/20 0.30
BAZ2B Q9UIF8 1/20 0.30
BAZ2A Q9UIF9 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL9522911 0.88 NPC1 (0.31) MAPTALDH1A1
SCHEMBL9706612 0.88 LMNA (0.35) LMNAMAPTHPGDSMN1; SMN2CYP1A2
SCHEMBL9521572 0.87 LMNA (0.34) LMNAMAPTHPGDSMN1; SMN2MEN1
SCHEMBL9521004 0.86 NOTUM (0.31) HPGDSMN1; SMN2
SCHEMBL9706624 0.82 LMNA (0.34) LMNAMAPTHPGDSMN1; SMN2CYP1A2
SCHEMBL10411538 0.81 LMNA (0.34) LMNAMAPTHPGDSMN1; SMN2MEN1
SCHEMBL10410791 0.80 LMNA (0.33) LMNAMAPTHPGDSMN1; SMN2MEN1
SCHEMBL9468954 0.78 MAPT (0.35) LMNAMAPTHPGDSMN1; SMN2KMT2A
SCHEMBL10645885 0.78 MAPT (0.35) LMNAMAPTHPGDSMN1; SMN2CYP1A2
SCHEMBL10647266 0.76 MAPT (0.34) LMNAMAPTHPGDSMN1; SMN2BAZ2B

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
EP-0323487-B1 HETEROCYCLIC COMPOUNDS CIBA-GEIGY AG (CH) 1993-03-31 EP claimed
US-4941909-A HERBICIDES, PYRIMIDONE BENZOATES HOFFMANN-LA ROCHE INC. (US) 1990-07-17 US disclosed