SCHEMBL28348408

SCHEMBL28348408

CCCCCCCCc1ccc(-c2ccc3c(Oc4ccccc4)csc3c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RARB P10826 7/20 0.41
RARA P10276 2/20 0.41
RARG P13631 1/20 0.41
ICAM1 P05362 1/20 0.41
SELE P16581 1/20 0.41
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
MTOR P42345 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL28348622 1.00 RARB (0.41) RARBRARARARGICAM1SELE
SCHEMBL28352075 1.00 RARB (0.41) RARBRARARARGICAM1SELE
SCHEMBL28351620 1.00 RARB (0.41) RARBRARARARGICAM1SELE
SCHEMBL28348588 1.00 RARB (0.41) RARBRARARARGICAM1SELE
SCHEMBL28348631 0.99 HSD11B1 (0.40) RARBRARARARGICAM1SELE
SCHEMBL28348126 0.86 NPC1 (0.38) ICAM1SELEALDH1A1MAPT
SCHEMBL28351584 0.83 ICAM1 (0.45) ICAM1SELEMEN1ALDH1A1KMT2A
SCHEMBL28351600 0.83 ICAM1 (0.45) ICAM1SELEMEN1ALDH1A1KMT2A
SCHEMBL28348551 0.83 ICAM1 (0.45) ICAM1SELEMEN1ALDH1A1KMT2A
SCHEMBL28351771 0.83 ICAM1 (0.45) ICAM1SELEMEN1ALDH1A1KMT2A

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
CN-110734452-A semiconductor materials, and preparation method and application thereof 北京大学深圳研究生院 2020-01-31 CN disclosed