SCHEMBL15935618

SCHEMBL15935618

Cc1cc(Oc2ncc(C(F)(F)F)cc2Cl)ccc1-c1c(O)c(C)nn(C)c1=O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.48
LMNA P02545 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
KMT2A Q03164 2/20 0.45
FFAR1 O14842 1/20 0.44
DRD1 P21728 5/20 0.43
LIPE Q05469 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 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
SCHEMBL15935598 0.90 RAB9A (0.46) RAB9ALMNASMN1; SMN2KMT2AFFAR1
SCHEMBL15935609 0.81 LMNA (0.48) RAB9ALMNASMN1; SMN2KMT2AFFAR1
SCHEMBL11299037 0.76 RAB9A (0.65) RAB9ALMNASMN1; SMN2KMT2AFFAR1
SCHEMBL15935602 0.75 KMT2A (0.47) RAB9ALMNASMN1; SMN2KMT2AFFAR1
SCHEMBL15935710 0.74 MAPK1 (0.44) RAB9ALMNAFFAR1MAPT
SCHEMBL20695067 0.74 L3MBTL1 (0.43) RAB9ALMNASMN1; SMN2KMT2AMAPT
SCHEMBL16638538 0.74 RAB9A (0.62) RAB9ALMNASMN1; SMN2KMT2AFFAR1
SCHEMBL15935705 0.73 POLB (0.34) FFAR1POLB
SCHEMBL15935629 0.73 LTA4H (0.41) LMNASMN1; SMN2DRD1ALDH1A1
SCHEMBL7941573 0.72 RAB9A (0.59) RAB9ALMNASMN1; SMN2KMT2AFFAR1

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-2014119770-A1 PYRIDAZINONE COMPOUND AND HERBICIDE COMPRISING SAME 住友化学株式会社 (JP) 2014-08-07 WO disclosed