SCHEMBL28414716

SCHEMBL28414716

CC(C)(C)c1ccc(O)c(-c2ccc3[nH]nnc3c2-c2cc(C(C)(C)C)ccc2O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 2/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40
RECQL P46063 1/20 0.40
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
NR2F2 P24468 1/20 0.34
CYP2D6 P10635 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PLA2G1B P04054 1/20 0.32
NFKB1 P19838 1/20 0.32
CASP3 P42574 1/20 0.32
NFKB2 Q00653 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
SCHEMBL11075897 0.87 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL31570221 0.87 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL31570218 0.83 MEN1 (0.40) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL31570219 0.83 MEN1 (0.40) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL4451239 0.83 MEN1 (0.40) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL30367475 0.81 HSP90AA1 (0.43) CYP3A4CYP2C9CYP2C19HSP90AA1
SCHEMBL28934071 0.80 PDE10A (0.35) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL11784775 0.76 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL10446182 0.75 KMT2A (0.40) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL7099284 0.73 CYP3A4 (0.38) MEN1KMT2AMAPTGAACYP2D6

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-114149754-A Grid adhesive film and preparation method and application thereof 苏州赛伍应用技术股份有限公司 2022-03-08 CN claimed
CN-109368000-B Environment-friendly light-resistant double-layer waterproof packaging bag and preparation method thereof 广州新文塑料有限公司 2020-05-08 CN disclosed