SCHEMBL421089

SCHEMBL421089

Cc1cc(C)c(NC(=O)c2ccc(Br)cc2)c(C)c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.59
RAPGEF4 Q8WZA2 1/20 0.51
RAB9A P51151 3/20 0.51
NPC1 O15118 2/20 0.51
TP53 P04637 1/20 0.51
MAPK1 P28482 1/20 0.51
CCNA2 P20248 1/20 0.51
CDK2 P24941 1/20 0.51
CCNA1 P78396 1/20 0.51
LCK P06239 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 1/20 0.50
POLB P06746 1/20 0.50
KMT2A Q03164 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.49

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
SCHEMBL31680606 0.91 PKM (0.68) PKMRAB9ANPC1LCKSMN1; SMN2
SCHEMBL27645790 0.82 LCK (0.66) PKMRAB9ANPC1TP53LCK
SCHEMBL774092 0.82 LCK (0.79) RAB9ANPC1LCKSMN1; SMN2MEN1
SCHEMBL12581572 0.82 GRM5 (0.57) PKMRAPGEF4RAB9ANPC1LCK
SCHEMBL7296065 0.81 PKM (0.57) PKMRAB9ANPC1TP53MAPK1
SCHEMBL2917557 0.81 PKM (0.60) PKMLCKSMN1; SMN2ALDH1A1LMNA
SCHEMBL18585517 0.78 SMN1; SMN2 (0.62) PKMRAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL1753199 0.75 RAB9A (0.81) RAB9ANPC1TP53SMN1; SMN2MEN1
SCHEMBL8042295 0.75 RAB9A (0.81) RAB9ANPC1TP53SMN1; SMN2MEN1
SCHEMBL11976313 0.74 MAPT (0.48) PKMRAB9ANPC1MAPK1LCK

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9673405-B2 Organic electroluminescent device, display apparatus, and lighting apparatus KONICA MINOLTA HOLDINGS, INC. (JP) 2017-06-06 US disclosed
US-9673405-B2 Organic electroluminescent device, display apparatus, and lighting apparatus KONICA MINOLTA HOLDINGS, INC. (JP) 2017-06-06 US disclosed
US-9673405-B2 Organic electroluminescent device, display apparatus, and lighting apparatus KONICA MINOLTA HOLDINGS, INC. (JP) 2017-06-06 US disclosed
US-20120018714-A1 ORGANIC ELECTROLUMINESCENT DEVICE, DISPLAY APPARATUS, AND LIGHTING APPARATUS KONICA MINOLTA HOLDINGS, INC. (JP) 2012-01-26 US disclosed
US-20120018714-A1 ORGANIC ELECTROLUMINESCENT DEVICE, DISPLAY APPARATUS, AND LIGHTING APPARATUS KONICA MINOLTA HOLDINGS, INC. (JP) 2012-01-26 US disclosed
US-20120018714-A1 ORGANIC ELECTROLUMINESCENT DEVICE, DISPLAY APPARATUS, AND LIGHTING APPARATUS KONICA MINOLTA HOLDINGS, INC. (JP) 2012-01-26 US disclosed