SCHEMBL21935536

SCHEMBL21935536

O=C(c1cc(O)c(O)cc1O)c1c(O)ccc(O)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 1/20 0.41
▸ HPGD P15428 3/20 0.41
▸ ALOX15 P16050 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ PTPN1 P18031 1/20 0.40
▸ SELL P14151 1/20 0.39
▸ SELP P16109 1/20 0.39
▸ RECQL P46063 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ APP P05067 1/20 0.38
▸ SMPD1 P17405 1/20 0.36
▸ CHRNA7 P36544 2/20 0.36
▸ HSD17B14 Q9BPX1 1/20 0.36
▸ GSTA1 P08263 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
SCHEMBL21935912 0.87 PTPN1 (0.50) HDAC1HPGDALOX15CYP1A2CYP2C9
SCHEMBL21935547 0.82 PTPN1 (0.45) HDAC1HPGDALOX15CYP1A2CYP2C9
SCHEMBL21935546 0.82 HDAC1 (0.47) HDAC1HPGDALOX15CYP1A2CYP2C9
SCHEMBL21935554 0.82 HDAC1 (0.53) HDAC1HPGDALOX15CYP1A2CYP2C9
SCHEMBL21935549 0.81 PTPN1 (0.46) HDAC1HPGDALOX15CYP1A2CYP2C9
SCHEMBL21935540 0.79 SELL (0.44) HDAC1HPGDALOX15CYP1A2CYP2C9
SCHEMBL8649470 0.79 HDAC1 (0.60) HDAC1HPGDALOX15CYP1A2CYP2C9
SCHEMBL21935544 0.78 HDAC1 (0.59) HDAC1HPGDALOX15SELLSELP
SCHEMBL21935533 0.78 HSD17B14 (0.42) HDAC1HPGDALOX15CYP1A2CYP2C9
SCHEMBL21935553 0.77 HDAC1 (0.47) HDAC1HPGDPTPN1SELLSELP

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
US-10894887-B2 Composition for forming film protecting against aqueous hydrogen peroxide solution NISSAN CHEMICAL CORPORATION (JP) 2021-01-19 — — US disclosed
US-20200131376-A1 COMPOSITION FOR FORMING FILM PROTECTING AGAINST AQUEOUS HYDROGEN PEROXIDE SOLUTION NISSAN CHEMICAL CORPORATION (JP) 2020-04-30 — — US disclosed
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