SCHEMBL11524848

SCHEMBL11524848

CNC(=S)N1C(C)CCCC1C

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.54
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
PHGDH O43175 1/20 0.41
RECQL P46063 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
LMNA P02545 1/20 0.33
ACE P12821 1/20 0.33
POLB P06746 1/20 0.32
ACHE P22303 1/20 0.32
HTT P42858 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL11529508 0.72 HTT (0.53) MAPTKMT2ASMN1; SMN2ALDH1A1HPGD
SCHEMBL27470351 0.65 RECQL (0.58) MGLLKMT2ARECQLALDH1A1GLA
SCHEMBL7295033 0.64 LMNA (0.46) LMNA
SCHEMBL7295038 0.64 LMNA (0.46) LMNA
SCHEMBL304820 0.64 TSHR (0.50) MGLLRECQLSMN1; SMN2ALDH1A1GLA
SCHEMBL14438970 0.64 RECQL (0.56) MGLLKMT2ARECQLSMN1; SMN2ALDH1A1
SCHEMBL14426767 0.64 RECQL (0.56) MGLLKMT2ARECQLSMN1; SMN2ALDH1A1
SCHEMBL6627605 0.64 RECQL (0.56) MGLLKMT2ARECQLSMN1; SMN2ALDH1A1
SCHEMBL4678814 0.64 RECQL (0.56) MGLLKMT2ARECQLSMN1; SMN2ALDH1A1
SCHEMBL2828543 0.64 RECQL (0.56) MGLLKMT2ARECQLSMN1; SMN2ALDH1A1

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