SCHEMBL7340316

SCHEMBL7340316

CCOC(=O)CCCCCOc1ccccc1N(C)C(=O)c1ccc(N)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
GAA P10253 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PPARG P37231 1/20 0.40
LMNA P02545 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP1A2 P05177 1/20 0.39
MAOA P21397 1/20 0.39
LTA4H P09960 2/20 0.39
DHFR P00374 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
TBXAS1 P24557 2/20 0.39
PPARD Q03181 2/20 0.38
MEN1 O00255 1/20 0.37
NR1I2 O75469 1/20 0.37

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
SCHEMBL7778250 0.88 RAB9A (0.39) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL7373263 0.87 TBXAS1 (0.41) MAPTNPC1RAB9AGAAALDH1A1
SCHEMBL7337134 0.86 ALDH1A1 (0.49) MAPTALDH1A1LMNAL3MBTL1TDP1
SCHEMBL7374555 0.85 USP2 (0.45) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL7378158 0.85 TBXAS1 (0.41) MAPTNPC1RAB9AALDH1A1PPARG
SCHEMBL7379977 0.84 CHRM2 (0.41) MAPTRAB9APPARGLMNACYP3A4
SCHEMBL7378207 0.81 PTGDR2 (0.41) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL7368764 0.81 ALDH1A1 (0.46) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL7335672 0.81 KMT2A (0.44) MAPTNPC1RAB9AGAAALDH1A1
SCHEMBL7336314 0.81 MEN1 (0.38) ALDH1A1LMNALTA4HMEN1KMT2A

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
EP-0832061-B1 BENZAMIDE DERIVATIVES AND THEIR USE AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2001-09-05 EP disclosed
US-6054457-A Benzamide derivatives and their use as vasopressin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-25 US disclosed
EP-0832061-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-04-01 EP disclosed
WO-1996041795-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS VASOPRESSIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-12-27 WO disclosed