SCHEMBL29847076

SCHEMBL29847076

CC1C(CNC(=O)c2c(Cl)cnn2C)=NOC1Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ ALDH1A1 P00352 3/20 0.52
▸ MAPT P10636 2/20 0.52
▸ KMT2A Q03164 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ PKM P14618 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ HPGD P15428 3/20 0.42
▸ NR3C1 P04150 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ HTT P42858 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.36
▸ POLB P06746 1/20 0.36

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
SCHEMBL29846582 0.78 LMNA (0.53) LMNASMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL29846815 0.77 KMT2A (0.39) LMNASMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL29846116 0.77 KMT2A (0.38) LMNASMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL29846484 0.75 KDM4E (0.54) LMNASMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL29846546 0.74 ELANE (0.34) LMNASMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL29846818 0.74 PDE1C (0.36) LMNAKMT2APOLB
SCHEMBL29846759 0.72 UTS2R (0.38) LMNAHPGDNR3C1
SCHEMBL29846767 0.72 UTS2R (0.38) LMNAHPGDNR3C1
SCHEMBL29846627 0.72 MAPT (0.57) LMNASMN1; SMN2ALDH1A1MAPTKMT2A
SCHEMBL29846545 0.71 SMN1; SMN2 (0.38) LMNASMN1; SMN2ALDH1A1MAPTRAB9A

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
WO-2022123530-A1 BORONIC ACID COMPOUND 주식회사 엘지화학 2022-06-16 — — WO disclosed
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