SCHEMBL30375472

SCHEMBL30375472

Cc1ccccc1C(=O)c1ccc(O)cc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
USP2 O75604 1/20 0.61
GAA P10253 1/20 0.61
KEAP1 Q14145 1/20 0.61
NFE2L2 Q16236 1/20 0.61
HPGD P15428 2/20 0.54
LMNA P02545 1/20 0.54
CYP1A2 P05177 1/20 0.54
PGR P06401 1/20 0.54
CYP3A4 P08684 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
AR P10275 1/20 0.54
CHRM1 P11229 1/20 0.54
ALOX15 P16050 1/20 0.54
TBXA2R P21731 1/20 0.54
SLC6A2 P23975 1/20 0.54
CYP2C19 P33261 1/20 0.54
ADRA1A P35348 1/20 0.54
HIF1A Q16665 1/20 0.54

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
SCHEMBL5710153 1.00 MEN1 (0.61) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL13557813 0.87 ALDH1A1 (0.57) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL5709946 0.86 KMT2A (0.53) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL30375073 0.86 KMT2A (0.53) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL12909853 0.86 ALDH1A1 (0.51) MEN1KMT2AHPGDLMNACYP1A2
SCHEMBL29517975 0.85 MEN1 (0.69) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL93207 0.85 MEN1 (0.69) MEN1KMT2AUSP2GAAKEAP1
SCHEMBL5027349 0.83 LMNA (0.79) MEN1KMT2AGAAHPGDLMNA
SCHEMBL3358950 0.83 SPR (0.56) MEN1KMT2AGAAHPGDLMNA
SCHEMBL29357695 0.82 CES2 (0.73) MEN1KMT2AUSP2GAAKEAP1

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-113646052-B Reversible thermochromic composition, reversible thermochromic microcapsule pigment, and writing instrument 百乐墨水株式会社 2024-05-17 CN disclosed
CN-113785023-B Water-based ink composition for reversible thermochromic writing instrument, refill for refill and water-based ballpoint pen incorporating same 株式会社百乐 2023-05-12 CN disclosed