SCHEMBL31031253

SCHEMBL31031253

CCc1ccc2nc3cc(Cl)ccn3c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
GLA P06280 2/20 0.50
POLB P06746 2/20 0.50
GAA P10253 2/20 0.50
HPGD P15428 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PTPN1 P18031 1/20 0.41
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP2C9 P11712 3/20 0.38
ACSS2 Q9NR19 1/20 0.38
CYP2C19 P33261 2/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36

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
SCHEMBL31031215 0.77 KDM4E (0.54) KDM4EALDH1A1GLAPOLBGAA
SCHEMBL14685289 0.69 CYP2C9 (0.39) KDM4EALDH1A1PTPN1SMN1; SMN2CYP2C9
SCHEMBL15767382 0.68 CYP2C9 (0.38) KDM4EALDH1A1CYP2C9CYP2C19CYP3A4
SCHEMBL31031242 0.68 KDM4E (0.43) KDM4EALDH1A1GLAPOLBGAA
SCHEMBL18867171 0.67 IKBKB (0.43) KDM4EALDH1A1GLAPOLBGAA
SCHEMBL13073711 0.65 KDM4E (0.51) KDM4EALDH1A1HSD17B10MAPTSMN1; SMN2
SCHEMBL12296332 0.65 CYP2C9 (0.38) KDM4EALDH1A1POLBGAASMN1; SMN2
SCHEMBL12638559 0.65 MAP3K14 (0.38) ALDH1A1GAAHPGDMAPTCYP2C9
SCHEMBL23917391 0.64 KDM4E (0.59) KDM4EALDH1A1GLAPOLBGAA
SCHEMBL14685300 0.64 PARP1 (0.40) KDM4EALDH1A1GLAPOLBGAA

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-4658651-A1 NOVEL COMPOUNDS FOR TAU IMAGING Eli Lilly and Company (US) 2025-12-10 EP disclosed
WO-2024163546-A1 NOVEL COMPOUNDS FOR TAU IMAGING ELI LILLY AND COMPANY (US) 2024-08-08 WO disclosed