SCHEMBL7378335

SCHEMBL7378335

Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N(C)c3ccc(C)cc3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.52
CHRNB4 P30926 1/20 0.52
CHRNA3 P32297 1/20 0.52
CHRNA4 P43681 1/20 0.52
HTT P42858 2/20 0.51
RAB9A P51151 6/20 0.50
NPC1 O15118 5/20 0.50
ALDH1A1 P00352 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
LMNA P02545 2/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
TP53 P04637 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
HSD17B10 Q99714 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
KMT2A Q03164 2/20 0.49

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
SCHEMBL7371083 0.96 HTT (0.56) CHRNB2CHRNB4CHRNA3CHRNA4HTT
SCHEMBL7517678 0.94 NPC1 (0.47) CHRNB2CHRNB4CHRNA3CHRNA4HTT
SCHEMBL7367644 0.92 GAA (0.64) RAB9ANPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL7368408 0.90 HSD17B1 (0.58) CHRNB2CHRNB4CHRNA3CHRNA4HTT
SCHEMBL7376741 0.87 CHRNB2 (0.49) CHRNB2CHRNB4CHRNA3CHRNA4HTT
SCHEMBL7379522 0.87 NPC1 (0.56) CHRNB2CHRNB4CHRNA3CHRNA4HTT
SCHEMBL7374040 0.87 CHRNB2 (0.56) CHRNB2CHRNB4CHRNA3CHRNA4HTT
SCHEMBL7372735 0.87 CHRNB2 (0.49) CHRNB2CHRNB4CHRNA3CHRNA4HTT
SCHEMBL7375535 0.87 L3MBTL1 (0.50) CHRNB2CHRNB4CHRNA3CHRNA4HTT
SCHEMBL7374859 0.87 NAMPT (0.52) CHRNB2CHRNB4CHRNA3CHRNA4HTT

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-6211242-B1 CARDIOVASCULAR DISORDERS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-04-03 US disclosed
EP-0757670-B1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 1999-01-13 EP disclosed
WO-1995029152-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-02 WO disclosed