SCHEMBL10473152

SCHEMBL10473152

CCOC(=O)c1cn(C2CC2)c2nc(Cl)c(Cl)cc2c1=O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 1/20 0.44
▸ POLB P06746 2/20 0.44
▸ BAZ2B Q9UIF8 1/20 0.42
▸ BAZ2A Q9UIF9 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ DPP4 P27487 4/20 0.39
▸ CHRM2 P08172 1/20 0.39
▸ DRD1 P21728 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ELANE P08246 1/20 0.37

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
SCHEMBL7582040 0.91 ADRB2 (0.44) ADRB2POLBBAZ2BBAZ2AALDH1A1
SCHEMBL5422476 0.89 ADRB2 (0.51) ADRB2ALDH1A1LMNAMAPTHPGD
SCHEMBL9687476 0.85 CUL4A (0.36) ADRB2POLBLMNADPP4CHRM2
SCHEMBL7551608 0.83 ALDH1A1 (0.44) ADRB2POLBALDH1A1LMNAMAPT
SCHEMBL7231247 0.83 ADRB2 (0.46) ADRB2POLBBAZ2BBAZ2AALDH1A1
SCHEMBL6215444 0.83 DPP4 (0.52) POLBALDH1A1LMNAHPGDDPP4
SCHEMBL5809336 0.83 ADRB2 (0.53) ADRB2ALDH1A1LMNAMAPTHPGD
SCHEMBL10987423 0.83 ADRB2 (0.42) ADRB2POLBBAZ2BBAZ2AALDH1A1
SCHEMBL10470837 0.82 POLB (0.52) ADRB2POLBBAZ2BBAZ2AALDH1A1
SCHEMBL30298002 0.81 POLB (0.46) POLBBAZ2BBAZ2AALDH1A1LMNA

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-4956465-A Bactericides BAYER AKTIENGESELLSCHAFT (DE) 1990-09-11 — — US disclosed
US-4840954-A BACTERICIDE BAYER AKTIENGESELLSCHAFT (DE) 1989-06-20 — — US disclosed
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