SCHEMBL16255397

SCHEMBL16255397

C/C(=N\O)c1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FURIN P09958 1/20 0.50
LMNA P02545 2/20 0.47
POLB P06746 2/20 0.47
HPGD P15428 2/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CA9 Q16790 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MMP1 P03956 2/20 0.41

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
SCHEMBL2185353 0.88 LMNA (0.57) LMNAPOLBMAPTALDH1A1MEN1
SCHEMBL265248 0.88 LMNA (0.57) LMNAPOLBMAPTALDH1A1MEN1
Water SCHEMBL11590419 0.86 LMNA (0.55) LMNAPOLBMAPTALDH1A1MEN1
SCHEMBL8438349 0.82 FURIN (0.52) FURINPOLBHPGDMAPTRAB9A
SCHEMBL18960361 0.81 LIPE (0.47) LMNARAB9AMEN1KMT2A
SCHEMBL17487334 0.81 LIPE (0.47) LMNARAB9AMEN1KMT2A
Acetic Acid SCHEMBL8202609 0.80 LMNA (0.53) LMNAPOLBRAB9AALDH1A1MEN1
SCHEMBL753409 0.80 SCN9A (0.44) LMNAHPGDMAPTALDH1A1MEN1
SCHEMBL2970975 0.80 MAPT (0.62) FURINLMNAPOLBHPGDMAPT
SCHEMBL2544053 0.80 SCN9A (0.44) LMNAHPGDMAPTALDH1A1MEN1

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-2014184236-A1 SUBSTITUTED ISOXAZOLE DERIVATIVES BASF SE (DE) 2014-11-20 WO disclosed