SCHEMBL10997019

SCHEMBL10997019

O=C(Cl)c1cc2c(cc1Cl)OCO2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.42
RAB9A P51151 6/20 0.42
MAPK1 P28482 3/20 0.42
HPGD P15428 3/20 0.42
ALOX15 P16050 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
MEN1 O00255 4/20 0.40
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 5/20 0.39
CHEK2 O96017 1/20 0.39
MAOB P27338 1/20 0.39
MAPT P10636 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
SMN1; SMN2 Q16637 6/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 2/20 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
SCHEMBL4472381 0.84 ALDH1A1 (0.48) KMT2ARAB9AMAPK1HPGDALOX15
SCHEMBL27390221 0.84 KMT2A (0.42) KMT2ARAB9AMAPK1HPGDALOX15
SCHEMBL11832759 0.78 SMN1; SMN2 (0.51) KMT2ARAB9AMAPK1HPGDCYP1A2
SCHEMBL10914144 0.78 RAB9A (0.40) KMT2ARAB9AMAPK1HPGDALOX15
SCHEMBL14078325 0.76 ALDH1A1 (0.37) KMT2ARAB9AMAPK1HPGDCYP1A2
SCHEMBL11451990 0.76 ALDH1A1 (0.37) KMT2ARAB9AMAPK1HPGDCYP1A2
SCHEMBL4771857 0.75 MAPK1 (0.40) KMT2ARAB9AMAPK1HPGDALOX15
SCHEMBL5302174 0.75 AHR (0.53) KMT2ARAB9AMAPK1HPGDCYP3A4
SCHEMBL30787730 0.75 AHR (0.53) KMT2ARAB9AMAPK1HPGDCYP3A4
SCHEMBL101268 0.75 TSHR (0.42) KMT2AMAPK1HPGDALOX15MEN1

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
EP-0134485-A2 5-Cyclopropyl-5,8-dihydro-8-oxo-1,3-dioxolo-(4,5-g) quinoline-7-carboxylic acid, process for its preparation and bactericidal agent containing it BAYER AG (DE) 1985-03-20 EP claimed
EP-0134485-A2 5-Cyclopropyl-5,8-dihydro-8-oxo-1,3-dioxolo-(4,5-g) quinoline-7-carboxylic acid, process for its preparation and bactericidal agent containing it BAYER AG (DE) 1985-03-20 EP disclosed