SCHEMBL10667697

SCHEMBL10667697

CC(C)c1cccc(C(C)C)c1OCCNCCC(=O)N1CCCSc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
DRD4 P21917 1/20 0.41
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL10667312 0.88 POLB (0.51) POLBL3MBTL1DRD4TP53MAPT
SCHEMBL10661968 0.86 TSHR (0.46) POLBL3MBTL1TP53
SCHEMBL10668567 0.84 POLB (0.47) POLBL3MBTL1DRD4TP53MAPT
SCHEMBL10669664 0.82 MAPT (0.54) POLBL3MBTL1DRD4TP53MAPT
SCHEMBL10667350 0.82 POLB (0.46) POLBL3MBTL1DRD4TP53MAPT
SCHEMBL10660555 0.81 ALDH1A1 (0.49) POLBDRD4MAPT
SCHEMBL10662031 0.80 POLB (0.44) POLBL3MBTL1DRD4TP53MAPT
SCHEMBL10662501 0.80 SHMT2 (0.45) POLBL3MBTL1MAPT
SCHEMBL10662720 0.80 POLB (0.42) POLBL3MBTL1DRD4TP53MAPT
SCHEMBL10482981 0.78 POLB (0.39) POLBL3MBTL1DRD4TP53MAPT

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-4780462-A Antihypertensive 1,5-benzothiazepine derivatives and compositions thereof Kotokuki Seiya Kau Co., Ltd. (JP) 1988-10-25 US disclosed