SCHEMBL24904667

SCHEMBL24904667

CC1(C)c2ccccc2C2(c3ccccc3-c3ccccc32)c2cc(N(c3ccccc3)c3ccc(-c4ccc5c(c4)sc4ccccc45)cc3)ccc21

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL24646436 0.95 F9 (0.32)
SCHEMBL21558951 0.94 PDK2 (0.32) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL24646497 0.93 PDK2 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL21558979 0.92 ALDH1A1 (0.32) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23383291 0.92 PDK2 (0.32) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL24905253 0.91 ALDH1A1 (0.34) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL21559062 0.91 ABCB1 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL24647542 0.91 ALDH1A1 (0.35) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL24904572 0.90 ALDH1A1 (0.30) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23383290 0.90 PDK2 (0.34) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2

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
US-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed