SCHEMBL9195248

SCHEMBL9195248

CC1(C)Oc2ccc(F)cc2C(c2cccn(Cc3ccccc3)c2=O)C1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
HTT P42858 1/20 0.43
KCNE1 P15382 3/20 0.43
KCNQ1 P51787 3/20 0.43
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
HPGD P15428 1/20 0.42
ABCB1 P08183 4/20 0.39
BRD4 O60885 2/20 0.38
BRD2 P25440 1/20 0.38
BRD3 Q15059 1/20 0.38
BRDT Q58F21 1/20 0.38
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TP53 P04637 1/20 0.37
DRD2 P14416 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
SCHEMBL9194242 0.90 TP53 (0.46) SMN1; SMN2KMT2AMEN1HTTKCNE1
SCHEMBL9199615 0.89 ABCB1 (0.39) HTTKCNE1KCNQ1KDM4EALDH1A1
SCHEMBL9195978 0.86 ABCB1 (0.56) ABCB1
SCHEMBL9193746 0.86 POLB (0.44) KDM4EALDH1A1LMNAABCB1BRD4
SCHEMBL9197650 0.86 MAPT (0.41) KMT2AMEN1LMNAABCB1MAPT
SCHEMBL9198469 0.85 ABCC9 (0.40) KMT2AMEN1KDM4EALDH1A1BRD4
SCHEMBL9194983 0.83 MAPT (0.44) SMN1; SMN2KDM4EALDH1A1LMNABRD4
SCHEMBL9197589 0.79 MAPT (0.43) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1
SCHEMBL9200212 0.77 KDM4E (0.48) SMN1; SMN2KMT2AMEN1KCNE1KCNQ1
SCHEMBL9197632 0.77 MAPT (0.42) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1

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-0406656-B1 Chroman derivatives MERCK PATENT GMBH (DE) 1995-01-11 EP disclosed
US-5112839-A CHROMAN DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-05-12 US disclosed
EP-0406656-A1 Chroman derivatives MERCK PATENT GmbH (DE) 1991-01-09 EP disclosed