SCHEMBL30110746

SCHEMBL30110746

Cc1cc(OC(C)c2ccccc2)ccc1B(O)O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ IGLV6-57 P01721 1/20 0.49
▸ FFAR1 O14842 1/20 0.48
▸ ALOX5 P09917 1/20 0.46
▸ KCNH2 Q12809 1/20 0.43
▸ SCN3A Q9NY46 1/20 0.43
▸ LTB4R Q15722 7/20 0.43
▸ LTB4R2 Q9NPC1 7/20 0.43
▸ TDP1 Q9NUW8 1/20 0.41
▸ S1PR5 Q9H228 2/20 0.41
▸ S1PR1 P21453 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ BRD4 O60885 2/20 0.40
▸ CREBBP Q92793 2/20 0.40

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
SCHEMBL8497028 0.81 IGLV6-57 (0.51) IGLV6-57FFAR1ALOX5KCNH2SCN3A
SCHEMBL15193542 0.80 ALDH1A1 (0.46) TDP1MEN1KMT2ABRD4
SCHEMBL29636289 0.80 ALDH1A1 (0.46) TDP1MEN1KMT2ABRD4
SCHEMBL10269886 0.77 CA1 (0.53) FFAR1ALOX5KCNH2SCN3ALTB4R
SCHEMBL6904351 0.75 FFAR1 (0.61) IGLV6-57FFAR1ALOX5KCNH2SCN3A
SCHEMBL25408444 0.75 LMNA (0.43) TDP1MEN1KMT2A
SCHEMBL15156136 0.75 CA1 (0.55) TDP1
SCHEMBL13577180 0.74 IGLV6-57 (0.51) IGLV6-57FFAR1ALOX5KCNH2SCN3A
SCHEMBL5715746 0.73 FFAR1 (0.51) IGLV6-57FFAR1ALOX5LTB4RLTB4R2
SCHEMBL257849 0.72 FFAR1 (0.54) IGLV6-57FFAR1ALOX5KCNH2SCN3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115124534-A Non-nucleotide PRMT5 small molecule inhibitor, preparation method and application 中山大学 2022-09-30 — — CN disclosed
Send feedback