SCHEMBL11528331

SCHEMBL11528331

CCN(Sc1ccccc1)C(=O)NC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 3/20 0.38
GLA P06280 1/20 0.38
TSHR P16473 1/20 0.38
MTNR1A P48039 4/20 0.37
MTNR1B P49286 4/20 0.37
KDM4E B2RXH2 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PKM P14618 1/20 0.36
FFAR1 O14842 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
NOX1 Q9Y5S8 1/20 0.36
SLC6A3 Q01959 1/20 0.36
HSD17B10 Q99714 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35

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
SCHEMBL31319056 0.82 SMN1; SMN2 (0.44) SMN1; SMN2LMNAALDH1A1GLATSHR
SCHEMBL11529579 0.80 LMNA (0.50) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL9665436 0.79 SMN1; SMN2 (0.41) SMN1; SMN2LMNAALDH1A1GLATSHR
SCHEMBL5447739 0.77 SMN1; SMN2 (0.41) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL11833499 0.77 ALDH1A1 (0.43) SMN1; SMN2LMNAALDH1A1GLATSHR
SCHEMBL11528680 0.77 LMNA (0.42) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL5136604 0.74 LMNA (0.40) SMN1; SMN2MEN1KMT2ALMNAALDH1A1
SCHEMBL11530151 0.70 PKM (0.41) MEN1KMT2ALMNAALDH1A1TSHR
SCHEMBL966694 0.69 MEN1 (0.69) SMN1; SMN2MEN1KMT2AALDH1A1GLA
SCHEMBL11038122 0.68 SMN1; SMN2 (0.41) SMN1; SMN2LMNAALDH1A1GLATSHR

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
US-4156735-A SALIDIURETICS HOECHST AKTIENGESELLSCHAFT (DE) 1979-05-29 US disclosed
US-4118501-A SALIDIURETIC ACTIVITY HOECHST AKTIENGESELLSCHAFT (DE) 1978-10-03 US disclosed