SCHEMBL7369738

SCHEMBL7369738

Cc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=O)N(C)c3ccccc3OCCCCC(=O)O)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
RECQL P46063 1/20 0.43
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
FABP4 P15090 1/20 0.42
PPARD Q03181 1/20 0.42
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41
RAB9A P51151 2/20 0.40
ALDH1A1 P00352 2/20 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
SCHEMBL7373839 0.99 KMT2A (0.45) MEN1KMT2AMAPTSMN1; SMN2NPSR1
SCHEMBL7374300 0.99 KMT2A (0.45) MEN1KMT2AMAPTSMN1; SMN2NPSR1
SCHEMBL7376733 0.99 KMT2A (0.45) MEN1KMT2AMAPTSMN1; SMN2NPSR1
SCHEMBL7377924 0.97 MEN1 (0.46) MEN1KMT2AMAPTSMN1; SMN2NPSR1
SCHEMBL7749374 0.94 GAA (0.47) MEN1KMT2APOLBGAAPPARD
SCHEMBL7378099 0.93 L3MBTL1 (0.43) MEN1KMT2AMAPTSMN1; SMN2NPSR1
SCHEMBL7378419 0.92 L3MBTL1 (0.42) MEN1KMT2AMAPTSMN1; SMN2NPSR1
SCHEMBL7373554 0.92 RECQL (0.46) MEN1KMT2AMAPTSMN1; SMN2NPSR1
SCHEMBL7373461 0.91 RECQL (0.42) MEN1KMT2AMAPTSMN1; SMN2NPSR1
SCHEMBL7376897 0.91 RECQL (0.42) MEN1KMT2AMAPTSMN1; SMN2NPSR1

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 4 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
EP-0757670-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-12 EP disclosed
WO-1995029152-A1 BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-02 WO disclosed