SCHEMBL22939879

SCHEMBL22939879

c1ccc(-c2nc(-c3ccc4c(c3)sc3ccccc34)nc(-c3cccc4c3-c3ccccc3C43c4ccccc4-c4cccc5cccc3c45)n2)cc1

nearest known ligand 0.30

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
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
F9 P00740 1/20 0.30
ALOX5 P09917 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
SCHEMBL22646819 0.95 ADORA2A (0.31) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL22987193 0.95 ALDH1A1 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL22940385 0.94 PIM3 (0.30) ALOX5
SCHEMBL24647025 0.94 ALDH1A1 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL24039407 0.94 ALDH1A1 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23032811 0.92 LIMK1 (0.32) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL22940710 0.92 ALDH1A1 (0.32) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23032927 0.92 LIMK1 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL23032812 0.92 LIMK1 (0.33) ALDH1A1MAPTHPGDRAB9ASMN1; SMN2
SCHEMBL22646787 0.91 F9 (0.33) 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-20210036231-A1 Organic Electronic Device, Display and LIghting Devices Comprising the Same NOVALED GMBH (DE) 2021-02-04 US disclosed