SCHEMBL7493192

SCHEMBL7493192

COCCOc1cc2oc(=O)cc(C)c2cc1C(=O)NCCN

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.45
ALDH1A1 P00352 5/20 0.45
HSD17B10 Q99714 3/20 0.45
HPGD P15428 3/20 0.45
GLA P06280 2/20 0.45
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HSP90AA1 P07900 1/20 0.45
HSP90AB1 P08238 1/20 0.45
MAPT P10636 1/20 0.45
ALPG P10696 1/20 0.45
ALOX15 P16050 1/20 0.45
ALOX12 P18054 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
HDAC1 Q13547 1/20 0.44
HTT P42858 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
GFER P55789 1/20 0.42
KMT2A Q03164 3/20 0.42

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
SCHEMBL7484704 0.86 MAOB (0.45) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2
SCHEMBL7485681 0.85 KDM4E (0.50) KDM4EALDH1A1HSD17B10HPGDGLA
SCHEMBL8183672 0.73 HPGD (0.55) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2
SCHEMBL7484801 0.71 RAB9A (0.42) HPGDSMN1; SMN2HDAC1HTTKMT2A
SCHEMBL7485171 0.70 RAB9A (0.47) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2
SCHEMBL19000918 0.70 KDM4E (0.68) KDM4EALDH1A1HSD17B10HPGDGLA
SCHEMBL7484551 0.69 CCNC (0.36) KDM4EALDH1A1HPGDHDAC1KMT2A
SCHEMBL9229347 0.69 KDM4E (0.60) KDM4EALDH1A1HSD17B10HPGDGLA
SCHEMBL6825155 0.69 ALDH1A1 (0.47) KDM4EALDH1A1HPGDSMN1; SMN2HSP90AA1
SCHEMBL7493197 0.69 MEN1 (0.43) KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1204644-A1 SYNTHESIS OF SUBSTITUTED AMIDINES ELI LILLY AND COMPANY (US) 2002-05-15 EP disclosed
WO-2000078725-A1 SYNTHESIS OF SUBSTITUTED AMIDINES ELI LILLY AND COMPANY (US) 2000-12-28 WO disclosed
WO-2000078724-A2 IMIDAZOLINDERIVATIVES THEIR PREPARATION AND THEIR PHARMACEUTICAL USE ELI LILLY AND COMPANY (US) 2000-12-28 WO disclosed