SCHEMBL9724044

SCHEMBL9724044

CCOC(=O)C1CSCN1C(=O)Cc1ccc(C)cc1C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.36
POLB P06746 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 1/20 0.36
PREP P48147 1/20 0.36
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
KMT2A Q03164 1/20 0.35
MDM2 Q00987 1/20 0.35
ACE P12821 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 1/20 0.34
TSHR P16473 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL9724030 0.85 POLB (0.36) P2RX7POLBSMN1; SMN2MAPTPREP
SCHEMBL9386544 0.82 SMN1; SMN2 (0.34) P2RX7POLBSMN1; SMN2MAPTALDH1A1
SCHEMBL9724043 0.82 TSHR (0.42) P2RX7SMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL9724038 0.80 KMT2A (0.39) SMN1; SMN2PREPALDH1A1KMT2AACE
SCHEMBL9727473 0.80 FKBP1A (0.47) POLBSMN1; SMN2ALDH1A1KMT2AHSD17B10
SCHEMBL8875741 0.80 ALDH1A1 (0.38) P2RX7POLBSMN1; SMN2ALDH1A1LMNA
SCHEMBL8879447 0.80 POLB (0.41) P2RX7POLBSMN1; SMN2ALDH1A1LMNA
SCHEMBL8877111 0.79 ALDH1A1 (0.37) P2RX7POLBSMN1; SMN2ALDH1A1LMNA
SCHEMBL8877150 0.79 POLB (0.39) P2RX7POLBSMN1; SMN2ALDH1A1LMNA
SCHEMBL8877501 0.78 MDM2 (0.39) P2RX7POLBSMN1; SMN2ALDH1A1LMNA

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-5116836-A Herbicides, insecticides, miticides BAYER AKTIENGESELLSCHAFT (DE) 1992-05-26 US disclosed