SCHEMBL21573535

SCHEMBL21573535

N#COc1ccc(Cc2ccc(NC(=O)Nc3ccc(Cc4ccc(C#N)cc4)cc3)cc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SAE1 Q9UBE0 3/20 0.78
UBA2 Q9UBT2 3/20 0.78
MAPT P10636 4/20 0.64
LMNA P02545 3/20 0.64
KMT2A Q03164 3/20 0.64
MEN1 O00255 2/20 0.64
KDM4E B2RXH2 2/20 0.64
POLB P06746 2/20 0.64
PKM P14618 1/20 0.64
MAPK1 P28482 1/20 0.64
RAB9A P51151 1/20 0.64
IL18 Q14116 1/20 0.64
CA12 O43570 3/20 0.56
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA9 Q16790 3/20 0.56
TSHR P16473 2/20 0.54
HTT P42858 1/20 0.54
NLRP3 Q96P20 1/20 0.54
KDR P35968 1/20 0.51

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
SCHEMBL19216513 0.93 SAE1 (0.64) SAE1UBA2MAPTLMNAKMT2A
SCHEMBL20432994 0.83 LOXL2 (0.48) SAE1UBA2MAPTRAB9ACA1
SCHEMBL19214036 0.82 SAE1 (0.50) SAE1UBA2MAPTLMNAKMT2A
SCHEMBL19214037 0.82 SAE1 (0.51) SAE1UBA2MAPTLMNAKMT2A
SCHEMBL14668125 0.81 TSHR (0.56) SAE1UBA2MAPTLMNAKMT2A
SCHEMBL19043004 0.80 SAE1 (0.55) SAE1UBA2MAPTLMNAKDM4E
SCHEMBL11054945 0.78 MAPT (0.81) SAE1UBA2MAPTLMNAKMT2A
SCHEMBL23048447 0.77 SAE1 (0.44) SAE1UBA2MAPTLMNAKMT2A
SCHEMBL4113028 0.77 MAPT (0.71) SAE1UBA2MAPTLMNAKMT2A
SCHEMBL4113073 0.77 MAPT (0.71) SAE1UBA2MAPTLMNAKMT2A

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
EP-2860207-B1 URETHANE-BASED OPTICAL MEMBER AND METHOD FOR PRODUCING SAME HOYA CORP (JP) 2019-11-20 EP disclosed