SCHEMBL20041691

SCHEMBL20041691

Cc1cccc(-c2ccc3c(c2)n2c4ccccc4nc2n3C)c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.51
TP53 P04637 7/20 0.49
RXFP1 Q9HBX9 1/20 0.49
THRB P10828 1/20 0.48
HSD17B10 Q99714 3/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
PKM P14618 2/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
GFER P55789 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
SCHEMBL20041455 0.99 MAPT (0.50) MAPTTP53RXFP1THRBHSD17B10
SCHEMBL20041428 0.99 MAPT (0.50) MAPTTP53RXFP1THRBHSD17B10
SCHEMBL20929615 0.95 MAPT (0.51) MAPTTP53RXFP1THRBHSD17B10
SCHEMBL20041528 0.92 MEN1 (0.44) MAPTTP53RXFP1THRBHSD17B10
SCHEMBL20041525 0.92 MEN1 (0.44) MAPTTP53RXFP1THRBHSD17B10
SCHEMBL20041554 0.91 MEN1 (0.43) MAPTTP53RXFP1THRBHSD17B10
SCHEMBL20041687 0.89 THRB (0.47) MAPTTP53THRBHSD17B10MEN1
SCHEMBL17507390 0.89 MEN1 (0.44) MAPTTP53RXFP1HSD17B10MEN1
SCHEMBL20041689 0.89 MEN1 (0.44) MAPTTP53RXFP1HSD17B10MEN1
SCHEMBL20041551 0.89 MEN1 (0.46) MAPTTP53RXFP1THRBHSD17B10

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-2982676-B1 Benzimidazo[2,1-B]benzoxazoles for electronic applications IDEMITSU KOSAN CO (JP) 2018-04-11 EP disclosed