SCHEMBL22732802

SCHEMBL22732802

O=C1C(c2ccncc2)C1c1ccncc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
RAB9A P51151 1/20 0.46
MAPK10 P53779 1/20 0.46
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
LMNA P02545 4/20 0.38
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP19A1 P11511 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
BCHE P06276 1/20 0.36
USP2 O75604 1/20 0.35
PARP1 P09874 1/20 0.35
MEN1 O00255 2/20 0.35

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
SCHEMBL26234982 0.82 MAPT (0.42) MAPTSMN1; SMN2NPC1TP53RAB9A
SCHEMBL27751124 0.69 MAPT (0.50) MAPTSMN1; SMN2NPC1TP53RAB9A
SCHEMBL4309904 0.69 MAPT (0.50) MAPTSMN1; SMN2NPC1TP53RAB9A
SCHEMBL20365810 0.69 MAPT (0.35) MAPTSMN1; SMN2NPC1TP53RAB9A
SCHEMBL30622715 0.65 MAPT (0.50) MAPTSMN1; SMN2NPC1TP53RAB9A
SCHEMBL785036 0.64 ESR2 (0.59) MAPTSMN1; SMN2NPC1TP53RAB9A
SCHEMBL855370 0.64 RAB9A (1.00) MAPTSMN1; SMN2NPC1TP53RAB9A
SCHEMBL7564358 0.64 MAPT (0.63) MAPTSMN1; SMN2NPC1TP53RAB9A
SCHEMBL18919013 0.63
SCHEMBL12533707 0.63 CYP1A2 (0.43) MAPTSMN1; SMN2NPC1TP53RAB9A

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-3978537-B1 POLAR GROUP-CONTAINING OLEFIN COPOLYMER UNIV TOKYO (JP) 2023-09-13 EP disclosed
WO-2020241715-A1 POLAR GROUP-CONTAINING OLEFIN COPOLYMER 国立大学法人東京大学 2020-12-03 WO disclosed