Benzoin

Benzoin

SCHEMBL7766715

O=C(c1ccccc1)C(O)c1ccccc1.[Ni]

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.95
LMNA P02545 3/20 0.95
CES1 P23141 3/20 0.95
ALDH1A1 P00352 2/20 0.65
KDM4E B2RXH2 1/20 0.65
TDP1 Q9NUW8 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
MAPK1 P28482 1/20 0.60
CYP3A4 P08684 1/20 0.48
HPGD P15428 1/20 0.48
ALKBH5 Q6P6C2 1/20 0.46
MDM2 Q00987 1/20 0.45
CYP2D6 P10635 1/20 0.44
SRC P12931 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
Benzoin SCHEMBL11763071 0.98 CES2 (0.91) CES2LMNACES1ALDH1A1KDM4E
Benzoin SCHEMBL28120851 0.98 CES2 (1.00) CES2LMNACES1ALDH1A1KDM4E
Benzoin SCHEMBL901258 0.98 CES2 (1.00) CES2LMNACES1ALDH1A1KDM4E
Benzoin SCHEMBL2025536 0.98 CES2 (1.00) CES2LMNACES1ALDH1A1KDM4E
Benzoin SCHEMBL145 0.98 CES2 (1.00) CES2LMNACES1ALDH1A1KDM4E
Benzoin SCHEMBL27696284 0.98 CES2 (1.00) CES2LMNACES1ALDH1A1KDM4E
Benzoin SCHEMBL5833429 0.98 CES2 (1.00) CES2LMNACES1ALDH1A1KDM4E
Benzoin SCHEMBL10665271 0.98 CES2 (1.00) CES2LMNACES1ALDH1A1KDM4E
Benzoin SCHEMBL4527488 0.95 CES2 (0.95) CES2LMNACES1ALDH1A1KDM4E
Benzoin SCHEMBL11590328 0.95 CES2 (0.95) CES2LMNACES1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0737722-B1 New indoaniline metal complex, process for their production, and transparent recording medium and optical recording medium by use thereof JUJO PAPER CO LTD (JP) 2001-07-04 EP disclosed
US-5919928-A Phenanthridine derivatives and metal complexes thereof used for transparent recording medium or optical recording medium NIPPON PAPER INDUSTRIES, CO., LTD. (JP) 1999-07-06 US disclosed
US-5892042-A OPTICAL RECORDING MEDIA WITH ACRIDINE DYES ON TRANSPARENT SUBSTRATE NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1999-04-06 US disclosed
US-5792863-A HAVING LARGE ABSORPTION IN NEAR INFRARED, REDUCED ABSORPTION IN VISIBLE RANGE NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1998-08-11 US disclosed
EP-0737722-A2 New indoaniline metal complex, process for their production, and transparent recording medium and optical recording medium by use thereof NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1996-10-16 EP disclosed