SCHEMBL28969986

SCHEMBL28969986

C=Cc1ccc(-c2ncnc(-c3ccccc3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
TSHR P16473 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.39
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 2/20 0.38
HPGD P15428 1/20 0.38
EGFR P00533 1/20 0.37
NPC1 O15118 5/20 0.37
RAB9A P51151 5/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
NFKB1 P19838 2/20 0.36
NFKB2 Q00653 2/20 0.36
RELA Q04206 2/20 0.36
POLB P06746 2/20 0.36
IDH1 O75874 1/20 0.36
HRH4 Q9H3N8 1/20 0.36
HDAC2 Q92769 1/20 0.35
ADORA3 P0DMS8 1/20 0.35

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
SCHEMBL17127168 0.88 ALDH1A1 (0.54) ALDH1A1TSHRL3MBTL1KMT2AMAPT
SCHEMBL20617811 0.86 ALDH1A1 (0.52) ALDH1A1TSHRL3MBTL1KMT2AMAPT
SCHEMBL12699700 0.86 ALDH1A1 (0.52) ALDH1A1TSHRL3MBTL1KMT2AMAPT
SCHEMBL12699691 0.86 ALDH1A1 (0.52) ALDH1A1TSHRL3MBTL1KMT2AMAPT
SCHEMBL13223710 0.86 ALDH1A1 (0.52) ALDH1A1TSHRL3MBTL1KMT2AMAPT
SCHEMBL20617804 0.86 ALDH1A1 (0.52) ALDH1A1TSHRL3MBTL1KMT2AMAPT
SCHEMBL23008279 0.82 NPC1 (0.52) ALDH1A1L3MBTL1KMT2AMAPTMEN1
SCHEMBL13719392 0.82 NPC1 (0.52) ALDH1A1L3MBTL1KMT2AMAPTMEN1
SCHEMBL16922581 0.82 NPC1 (0.52) ALDH1A1L3MBTL1KMT2AMAPTMEN1
SCHEMBL23008430 0.82 NPC1 (0.52) ALDH1A1L3MBTL1KMT2AMAPTMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115819661-A Non-conjugated polymer thermal excitation delay fluorescent material based on phenylacridine and phenyltriazine substituent 黑龙江大学 2023-03-21 CN claimed
CN-115819661-A Non-conjugated polymer thermal excitation delay fluorescent material based on phenylacridine and phenyltriazine substituent 黑龙江大学 2023-03-21 CN disclosed