SCHEMBL28517393

SCHEMBL28517393

COc1ncnc(Oc2c[c]ccc2)c1N

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.36
▸ LMNA P02545 3/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ MRGPRX1 Q96LB2 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ MAPT P10636 3/20 0.33
▸ RET P07949 2/20 0.33
▸ KDR P35968 2/20 0.33
▸ EGFR P00533 2/20 0.33
▸ KIF5B P33176 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ LCK P06239 1/20 0.33
▸ CSF1R P07333 1/20 0.32
▸ PDGFRB P09619 1/20 0.32
▸ FLT4 P35916 1/20 0.32
▸ FLT3 P36888 1/20 0.32
▸ HPGD P15428 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
SCHEMBL28514423 0.83 LMNA (0.39) TRPA1LMNARAB9AMEN1KMT2A
SCHEMBL21858763 0.82 TRPA1 (0.50) TRPA1LMNARAB9AMEN1KMT2A
SCHEMBL21611401 0.77 LMNA (0.53) LMNARAB9AMEN1KMT2APOLB
SCHEMBL21611480 0.77 SMN1; SMN2 (0.56) LMNARAB9AMEN1KMT2AMAPT
SCHEMBL28523656 0.77 MAPT (0.47) LMNAMEN1KMT2AMAPT
SCHEMBL21611512 0.75 MAP4K4 (0.48) TRPA1LMNAKMT2AFLT3
SCHEMBL21611499 0.75 LMNA (0.56) LMNAMRGPRX1MAPTRETKDR
SCHEMBL21611513 0.73 EGFR (0.60) LMNAMEN1KMT2AMAPTRET
SCHEMBL21611408 0.73 MRGPRX1 (0.52) TRPA1LMNAMEN1KMT2AMRGPRX1
SCHEMBL21611421 0.73 EGFR (0.60) LMNAMEN1KMT2AMAPTRET

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-112368276-A Amino-pyrimidinone derivatives, process for their preparation and pharmaceutical compositions containing them 法国施维雅药厂 2021-02-12 — — CN disclosed
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