SCHEMBL18773534

SCHEMBL18773534

CN(C)CCCNC(=O)c1cccc(C(=O)O)c1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ HPGD P15428 2/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ HSD17B10 Q99714 1/20 0.56
▸ SIGMAR1 Q99720 4/20 0.55
▸ TMEM97 Q5BJF2 3/20 0.55
▸ FYN P06241 1/20 0.53
▸ MAPK14 Q16539 1/20 0.51
▸ NAMPT P43490 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL26210939 0.91 SMN1; SMN2 (0.55) SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL24849909 0.88 HPGD (0.57) SMN1; SMN2HPGDMEN1KMT2AKDM4E
SCHEMBL31245842 0.88 HPGD (0.57) SMN1; SMN2HPGDMEN1KMT2AKDM4E
SCHEMBL12629216 0.86 SIGMAR1 (0.57) SMN1; SMN2SIGMAR1TMEM97
SCHEMBL18773532 0.86 SMN1; SMN2 (0.62) SMN1; SMN2SIGMAR1TMEM97L3MBTL1
SCHEMBL2120631 0.86 HPGD (0.68) SMN1; SMN2HPGDMEN1KMT2AKDM4E
SCHEMBL842218 0.85 NPC1 (0.59) SMN1; SMN2HPGDMEN1KMT2AKDM4E
SCHEMBL12094830 0.85 SIGMAR1 (0.56) SMN1; SMN2KDM4ESIGMAR1TMEM97
SCHEMBL9491823 0.84 SMN1; SMN2 (0.67) SMN1; SMN2NAMPTL3MBTL1
SCHEMBL1909677 0.84 KDM4E (0.55) SMN1; SMN2HPGDMEN1KMT2AKDM4E

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
US-9630950-B2 Inhibitors for steroid response elements and RNA polymerase II and related methods CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2017-04-25 — — US disclosed
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