SCHEMBL11237337

SCHEMBL11237337

ON=C(c1ccccc1)n1cnnc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
TYMP P19971 2/20 0.38
GAA P10253 2/20 0.35
CYP2C19 P33261 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
DRD4 P21917 1/20 0.33
MAPK14 Q16539 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HPGD P15428 1/20 0.32
GFER P55789 1/20 0.32
NOTUM Q6P988 1/20 0.32
LMNA P02545 2/20 0.32
POLB P06746 1/20 0.32
MITF O75030 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
RECQL P46063 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
SCHEMBL11237336 1.00 SMN1; SMN2 (0.44) SMN1; SMN2TYMPGAACYP2C19CA12
SCHEMBL11242371 0.77 CYP19A1 (0.42) LMNAPOLBMAPTCYP1A2CYP3A4
SCHEMBL11242350 0.77 CYP19A1 (0.42) LMNAPOLBMAPTCYP1A2CYP3A4
SCHEMBL11234150 0.71 ELANE (0.40) TYMPALDH1A1MAPTTSHR
SCHEMBL11234147 0.71 ELANE (0.40) TYMPALDH1A1MAPTTSHR
SCHEMBL11233969 0.69 CYP19A1 (0.39) SMN1; SMN2TYMPCA12CA1CA2
SCHEMBL11233965 0.69 CYP19A1 (0.39) SMN1; SMN2TYMPCA12CA1CA2
SCHEMBL11232470 0.69 ALDH1A1 (0.50) SMN1; SMN2TYMPGAAALDH1A1LMNA
SCHEMBL11232464 0.69 ALDH1A1 (0.50) SMN1; SMN2TYMPGAAALDH1A1LMNA
SCHEMBL11230902 0.67 SMN1; SMN2 (0.41) SMN1; SMN2CA12CA1CA2CA9

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-4359469-A Combating pests with N-sulphenylated oxime-carbamates BAYER AKTIENGESELLSCHAFT (DE) 1982-11-16 US disclosed