SCHEMBL27970723

SCHEMBL27970723

CC(=O)Nc1ccc(C2CC2OC(=O)NC(C)(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
KDM1A O60341 2/20 0.41
NAMPT P43490 1/20 0.40
HTT P42858 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
CA12 O43570 1/20 0.38
BRD4 O60885 1/20 0.38
NR1I2 O75469 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
MB P02144 1/20 0.38

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
SCHEMBL14673029 0.86 KDM1A (0.36) SMN1; SMN2KDM1ANPC1RAB9AMEN1
SCHEMBL14673217 0.84 KDM1A (0.56) SMN1; SMN2KDM1AMAPTNPC1RAB9A
SCHEMBL27973992 0.83 TSHR (0.38) SMN1; SMN2KDM1AMAPTALDH1A1KDM4E
SCHEMBL27970716 0.82 KDM1A (0.37) KDM1AHTTMAPTRAB9AALDH1A1
SCHEMBL2564602 0.82 KDM1A (0.37) KDM1AALDH1A1CYP3A4
SCHEMBL27706519 0.82 TACR1 (0.42) SMN1; SMN2KDM1A
SCHEMBL28271460 0.82 SLC6A4 (0.40)
SCHEMBL27891314 0.82 KDM1A (0.51) SMN1; SMN2KDM1ANAMPTHTTALDH1A1
SCHEMBL14673009 0.78 NPC1 (0.41) SMN1; SMN2MAPTNPC1RAB9AMEN1
SCHEMBL31727845 0.76 KDM1A (0.36) KDM1AMAPTNPC1RAB9AALDH1A1

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
CN-103857393-B Cyclopropylamine is as LSD1 inhibitor 葛兰素史密斯克莱知识产权(第2 号)有限公司 2016-08-17 CN disclosed
CN-103857393-A Cyclopropylamines as LSD1 inhibitors GLAXOSMITHKLINE LLC 2014-06-11 CN disclosed