SCHEMBL24901003

SCHEMBL24901003

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccc(-c7ccccc7)c7oc8ccccc8c67)c5c43)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC14B O60729 2/20 0.38
CDC14A Q9UNH5 2/20 0.38
MAPT P10636 8/20 0.36
ALDH1A1 P00352 6/20 0.36
TSHR P16473 5/20 0.36
KDM4E B2RXH2 3/20 0.36
POLB P06746 2/20 0.36
LMNA P02545 4/20 0.36
HSD17B10 Q99714 3/20 0.36
MAPK1 P28482 2/20 0.36
NPSR1 Q6W5P4 2/20 0.35
CYP17A1 P05093 1/20 0.35
CYP19A1 P11511 1/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
HPGD P15428 1/20 0.34
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
ALOX12 P18054 1/20 0.33
USP2 O75604 1/20 0.33

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
SCHEMBL24901001 0.94 MAPT (0.36) CDC14BCDC14AMAPTALDH1A1TSHR
SCHEMBL22487389 0.90 MAPT (0.36) CDC14BCDC14AMAPTALDH1A1TSHR
SCHEMBL22487572 0.89 MAPT (0.36) CDC14BCDC14AMAPTALDH1A1TSHR
SCHEMBL22487550 0.89 MAPT (0.36) CDC14BCDC14AMAPTALDH1A1TSHR
SCHEMBL21236443 0.89 MAPT (0.40) CDC14BCDC14AMAPTALDH1A1TSHR
SCHEMBL22486216 0.89 MAPT (0.35) CDC14BCDC14AMAPTALDH1A1TSHR
SCHEMBL24900965 0.88 CDC14B (0.31) CDC14BCDC14AMAPTTSHRKDM4E
SCHEMBL24901017 0.88 MAPT (0.33) CDC14BCDC14AMAPTALDH1A1TSHR
SCHEMBL24881595 0.88 DHODH (0.34) MAPTALDH1A1TSHRKDM4EHSD17B10
SCHEMBL22486654 0.87 MAPT (0.35) CDC14BCDC14AMAPTALDH1A1TSHR

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
WO-2023287026-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2023-01-19 WO disclosed