SCHEMBL7009115

SCHEMBL7009115

O=C1Cc2ccccc2N1c1cccc(C(F)(F)F)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.62
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
DRD2 P14416 2/20 0.57
DRD3 P35462 2/20 0.57
DRD5 P21918 1/20 0.57
ALDH1A1 P00352 3/20 0.54
AR P10275 1/20 0.47
CYP1A2 P05177 1/20 0.46
TSHR P16473 1/20 0.46
CASP6 P55212 2/20 0.45
KCNH2 Q12809 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
GAA P10253 2/20 0.44
GALR3 O60755 1/20 0.43
HTR4 Q13639 1/20 0.43
ALOX5 P09917 1/20 0.43
PMM2 O15305 1/20 0.43
MPI P34949 1/20 0.43

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
SCHEMBL16110253 0.89 MEN1 (0.60) HPGDMEN1KMT2ADRD2DRD3
SCHEMBL28744553 0.82 MEN1 (0.70) MEN1KMT2ADRD2DRD3ALDH1A1
SCHEMBL29702930 0.82 MEN1 (0.70) MEN1KMT2ADRD2DRD3ALDH1A1
SCHEMBL16110147 0.81 HPGD (0.59) HPGDMEN1KMT2ADRD2DRD3
SCHEMBL6767398 0.81 HPGD (0.68) HPGDMEN1KMT2AALDH1A1CASP6
SCHEMBL6763292 0.79 HPGD (0.70) HPGDMEN1KMT2ADRD2DRD3
SCHEMBL16110144 0.79 MEN1 (0.52) HPGDMEN1KMT2ADRD2DRD3
SCHEMBL31422646 0.78 HPGD (1.00) HPGDMEN1KMT2ADRD2DRD3
SCHEMBL143970 0.78 HPGD (1.00) HPGDMEN1KMT2ADRD2DRD3
SCHEMBL6772536 0.78 HPGD (0.68) HPGDMEN1KMT2AALDH1A1CASP6

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-1349852-A2 4-(HETERO)ARYL SUBSTITUTED INDOLINONES Sugen, Inc. (US) 2003-10-08 EP claimed
WO-2002055517-A2 4-(HETERO)ARYL SUBSTITUTED INDOLINONES CUI JINGRONG (US) 2002-07-18 WO claimed