SCHEMBL7976970

SCHEMBL7976970

COC(=O)Cc1ccccc1-c1ccccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 3/20 0.50
APOBEC3G Q9HC16 1/20 0.50
ADORA2A P29274 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
RAB9A P51151 2/20 0.43
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CYP1A2 P05177 1/20 0.41
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
KMT2A Q03164 1/20 0.40
GRM4 Q14833 1/20 0.40

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
SCHEMBL1177969 0.81 KDM4E (0.53) KDM4EL3MBTL1LMNATDP1CYP1A2
SCHEMBL28139433 0.78 BRD4 (0.39) ALDH1A1KDM4EADORA2AL3MBTL1LMNA
SCHEMBL7784447 0.78 TDP1 (0.44) ALDH1A1KDM4EAPOBEC3GRAB9ALMNA
SCHEMBL7525447 0.77 ADORA2A (0.40) ALDH1A1KDM4EADORA2ALMNAPKM
SCHEMBL2557632 0.77 EPHX1 (0.43) ALDH1A1KDM4ELMNACYP1A2MEN1
SCHEMBL4777973 0.77 KDM4E (0.50) ALDH1A1KDM4EADORA2AL3MBTL1RAB9A
SCHEMBL1554320 0.76 KDM4E (0.53) ALDH1A1KDM4EL3MBTL1LMNATDP1
SCHEMBL12869882 0.76 LMNA (0.55) ALDH1A1KDM4EAPOBEC3GRAB9ALMNA
SCHEMBL7353766 0.76 KMT2A (0.51) KDM4EL3MBTL1RAB9ALMNAKMT2A
SCHEMBL2555729 0.75 KCNA5 (0.51) ALDH1A1KDM4EADORA2ACYP1A2MEN1

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-1082307-A1 PROCESSES AND INTERMEDIATES FOR PREPARING 2-SUBSTITUTED PIPERIDINE STEREOISOMERS CELGENE CORPORATION (US) 2001-03-14 EP disclosed
WO-1999061425-A1 PROCESSES AND INTERMEDIATES FOR PREPARING 2-SUBSTITUTED PIPERIDINE STEREOISOMERS CELGENE CORPORATION (US) 1999-12-02 WO disclosed