SCHEMBL28889596

SCHEMBL28889596

[CH](c1ccc(-c2ccccc2)cc1)c1cccs1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.42
NPC1 O15118 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
MAPT P10636 7/20 0.41
ALDH1A1 P00352 7/20 0.41
KMT2A Q03164 5/20 0.41
HPGD P15428 4/20 0.41
KDM4E B2RXH2 4/20 0.41
MEN1 O00255 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
HCAR2 Q8TDS4 1/20 0.40
LMNA P02545 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HTT P42858 1/20 0.38
GAA P10253 1/20 0.38
NFKB1 P19838 1/20 0.38
CASP3 P42574 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SENP8 Q96LD8 1/20 0.38

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
SCHEMBL723432 0.87 SMN1; SMN2 (0.48) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL6506544 0.78 L3MBTL1 (0.46) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL28581898 0.78 RAB9A (0.43) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL723113 0.78 MAPT (0.44) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL2839493 0.75 ALDH1A1 (0.56) MAPTALDH1A1TDP1LMNAMAPK1
SCHEMBL559558 0.75 SMN1; SMN2 (0.59) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL8699745 0.73 CYP1A2 (0.56) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL291507 0.73 ALDH1A1 (0.53) MAPTALDH1A1TDP1LMNAMAPK1
SCHEMBL17538716 0.71 PTGS1 (0.49) RAB9ASMN1; SMN2MAPTKMT2AHPGD
2-Thiophenenecarboxaldehyde SCHEMBL4652735 0.70 SMN1; SMN2 (0.48) RAB9ANPC1SMN1; SMN2MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115029127-A Organic electroluminescent material composition and application thereof 北京云基科技有限公司 2022-09-09 CN disclosed
CN-114835626-A Organic electroluminescent compounds, various host materials and organic electroluminescent device comprising the same 罗门哈斯电子材料韩国有限公司 2022-08-02 CN disclosed
CN-114447242-A Multiple host materials, composition comprising the same, and organic electroluminescent device comprising the same 罗门哈斯电子材料韩国有限公司 2022-05-06 CN disclosed
CN-106459074-B Organic electroluminescent compounds and organic electroluminescent device comprising the same 罗门哈斯电子材料韩国有限公司 2020-08-04 CN disclosed
CN-111233826-A Dibenzothiophene compound containing fluoranthene group and organic electroluminescent device thereof 昱镭光电科技股份有限公司 2020-06-05 CN disclosed
CN-111087349-A Phenyl biphenyl pyrimidine compound and organic electroluminescent device thereof 昱镭光电科技股份有限公司 2020-05-01 CN disclosed