SCHEMBL8856838

SCHEMBL8856838

CNNC(=O)c1ccccc1Cl

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.77
▸ ALDH1A1 P00352 4/20 0.67
▸ L3MBTL1 Q9Y468 2/20 0.58
▸ HTT P42858 2/20 0.57
▸ HPGD P15428 2/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ TP53 P04637 1/20 0.56
▸ MAPT P10636 2/20 0.54
▸ GFER P55789 1/20 0.54
▸ CES2 O00748 1/20 0.54
▸ CES1 P23141 1/20 0.54
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ KDM4E B2RXH2 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ SMO Q99835 1/20 0.50

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
SCHEMBL8373805 0.87 POLB (1.00) POLBALDH1A1L3MBTL1HTTHPGD
SCHEMBL30452120 0.83 POLB (0.69) POLBALDH1A1L3MBTL1HPGDCYP1A2
SCHEMBL883582 0.83 POLB (0.69) POLBALDH1A1L3MBTL1HPGDCYP1A2
SCHEMBL11593314 0.82 POLB (0.81) POLBALDH1A1L3MBTL1HTTHPGD
SCHEMBL11822574 0.81 POLB (0.78) POLBALDH1A1L3MBTL1HTTTP53
Hydrochloric Acid SCHEMBL31393258 0.78 POLB (0.52) POLBALDH1A1L3MBTL1HTTHPGD
SCHEMBL3944834 0.78 POLB (0.62) POLBALDH1A1L3MBTL1HPGDCYP1A2
SCHEMBL8015608 0.78 CA1 (0.61) POLBALDH1A1HTTHPGDTP53
SCHEMBL18763268 0.78 POLB (0.61) POLBALDH1A1L3MBTL1HPGDKDM4E
SCHEMBL8857056 0.78 GAA (0.53) POLBALDH1A1HPGD

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
US-5698556-A TREATING CANCER CHAN CARCY L (US) 1997-12-16 — — US disclosed
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