SCHEMBL9030971

SCHEMBL9030971

CCOC(=O)Cc1cc(Cl)cn1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 1/20 0.43
BAZ2A Q9UIF9 1/20 0.43
KAT2B Q92831 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 2/20 0.38
RAB9A P51151 2/20 0.38
LMNA P02545 2/20 0.38
TSHR P16473 2/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX15 P16050 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
SCHEMBL6949726 0.87 SMN1; SMN2 (0.41) BAZ2BBAZ2AKAT2BKDM4EMAPT
SCHEMBL10812847 0.79 ALDH1A1 (0.38) BAZ2BBAZ2AKAT2BKDM4EMAPT
SCHEMBL11878553 0.76 SMN1; SMN2 (0.46) KDM4ESMN1; SMN2ALDH1A1RAB9ALMNA
SCHEMBL7675730 0.76 PPARA (0.40) SMN1; SMN2ALDH1A1RAB9ANPC1HPGD
SCHEMBL10990674 0.71 HSP90AB1 (0.42) KAT2BKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL9029575 0.71 BAZ2B (0.43) BAZ2BBAZ2AKAT2BKDM4EMAPT
SCHEMBL6367851 0.70 MAPT (0.51) KDM4EMAPTSMN1; SMN2RAB9ALMNA
SCHEMBL7676895 0.70 RAB9A (0.48) KDM4EMAPTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL6372557 0.70 MAPT (0.48) KDM4EMAPTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL19915720 0.70 TBXAS1 (0.48) KDM4EMAPTSMN1; SMN2RAB9ALMNA

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
EP-0714895-A1 Pyrrole derivatives F. Hoffmann-La Roche AG (CH) 1996-06-05 EP disclosed