SCHEMBL7339688

SCHEMBL7339688

O=Cc1ccccc1OCCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
MAPT P10636 2/20 0.60
HPGD P15428 5/20 0.59
ALDH1A1 P00352 3/20 0.59
HTT P42858 1/20 0.59
TSHR P16473 4/20 0.56
NPC1 O15118 2/20 0.56
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MAPK1 P28482 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL3447188 0.89 RAB9A (0.56) RAB9ASMN1; SMN2MAPTHPGDALDH1A1
SCHEMBL12284020 0.82 RAB9A (0.58) RAB9ASMN1; SMN2MAPTHPGDTSHR
SCHEMBL3446500 0.80 HPGD (0.44) RAB9ASMN1; SMN2MAPTHPGDALDH1A1
SCHEMBL15923755 0.80 RAB9A (0.62) RAB9ASMN1; SMN2MAPTHPGDALDH1A1
SCHEMBL7383650 0.80 TSHR (0.69) RAB9ASMN1; SMN2MAPTHPGDALDH1A1
SCHEMBL11019595 0.80 RAB9A (0.67) RAB9ASMN1; SMN2MAPTHPGDALDH1A1
SCHEMBL7525811 0.80 HTR1A (0.58) RAB9ASMN1; SMN2MAPTHPGDALDH1A1
SCHEMBL8372730 0.78 ALDH1A1 (0.87) SMN1; SMN2MAPTHPGDALDH1A1HTT
SCHEMBL5805320 0.78 ALDH1A1 (0.87) RAB9ASMN1; SMN2MAPTHPGDALDH1A1
SCHEMBL3626811 0.78 RAB9A (0.72) RAB9ASMN1; SMN2MAPTHPGDALDH1A1

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