SCHEMBL24856441

SCHEMBL24856441

CC1(C)c2ccccc2-c2c(-c3c(-c4ccccc4)cccc3N(c3ccccc3)c3ccc4c(c3)sc3ccccc34)cccc21

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F9 P00740 1/20 0.34
SLC9A1 P19634 2/20 0.32
ABCB1 P08183 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL25577760 0.95 F9 (0.34) F9SLC9A1ABCB1
SCHEMBL24840346 0.94 F9 (0.33) F9SLC9A1ABCB1
SCHEMBL25577763 0.94 F9 (0.33) F9SLC9A1ABCB1
SCHEMBL24840001 0.92 F9 (0.34) F9SLC9A1ABCB1ALDH1A1MAPT
SCHEMBL25577765 0.91 F9 (0.33) F9SLC9A1ABCB1
SCHEMBL23376174 0.91 F9 (0.32) F9
SCHEMBL24856307 0.91 F9 (0.34) F9ABCB1
SCHEMBL19596521 0.91 F9 (0.34) F9SLC9A1ABCB1ALDH1A1MAPT
SCHEMBL26599788 0.90 F9 (0.36) F9SLC9A1ABCB1ALDH1A1MAPT
SCHEMBL25577829 0.89 F9 (0.32) F9SLC9A1

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-2023273997-A1 ORGANIC COMPOUND AND APPLICATION THEREOF 北京鼎材科技有限公司 2023-01-05 WO disclosed