SCHEMBL7993896

SCHEMBL7993896

COC(=O)CN(C(=O)C(c1ccc2c(c1)OCO2)C(O)C1CCCCC1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 3/20 0.43
EDNRA P25101 3/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 3/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GPR55 Q9Y2T6 2/20 0.38
TP53 P04637 1/20 0.38
HTR1A P08908 1/20 0.38
CNR1 P21554 1/20 0.38
HTR7 P34969 1/20 0.38
HTR6 P50406 1/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL7975878 0.90 TRPM8 (0.44) TRPM8EDNRAKMT2AL3MBTL1ALDH1A1
SCHEMBL7993894 0.76 RXFP1 (0.42) EDNRAKMT2AMEN1TSHRGAA
SCHEMBL7987577 0.75 NPC1 (0.48) KMT2AMEN1TSHRALDH1A1MAPT
SCHEMBL7990600 0.73 SLC6A2 (0.43) TRPM8EDNRAMAPTHPGDSMN1; SMN2
SCHEMBL7976294 0.72 SLC6A2 (0.42) TRPM8EDNRAKMT2AMEN1L3MBTL1
SCHEMBL7993759 0.71 MME (0.52) TSHRALDH1A1HPGDHTT
SCHEMBL7986584 0.71 EDNRA (0.40) EDNRAMAPTHPGDSMN1; SMN2
SCHEMBL7975874 0.70 RXFP1 (0.44) TRPM8EDNRAKMT2AMEN1MAPT
SCHEMBL7993650 0.70 EDNRA (0.49) EDNRATSHRALDH1A1MAPTHPGD
SCHEMBL7976824 0.70 HPGD (0.46) KMT2AMEN1L3MBTL1ALDH1A1GAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6207686-B1 FOR THERAPY OF HYPERTENSION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-03-27 US disclosed
EP-0792265-A1 ENDOTHELIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-09-03 EP disclosed
WO-1996015109-A1 ENDOTHELIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-05-23 WO disclosed