SCHEMBL4579617

SCHEMBL4579617

[CH2]c1c(CCO)ccc(CNC(=O)O)c1CCO

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 2/20 0.31
HPGD P15428 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL268818 0.83 CYP1A2 (0.35) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL529644 0.71 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL7564251 0.71 ALDH1A1 (0.43) TSHRALDH1A1HPGDNPC1RAB9A
SCHEMBL17491790 0.65 HPGD (0.47) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL27500213 0.65 KMT2A (0.44) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL29935885 0.64 CYP1A2 (0.55) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL9156343 0.64 CYP1A2 (0.55) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL2943065 0.63 TSHR (0.42) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL5883325 0.63 KMT2A (0.55) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
Hydrochloric Acid SCHEMBL11157053 0.63 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C9TSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5698361-A DIAZONIUM COMPOUND, POLYMERIC BINDER; DURABILITY FUJI PHOTO FILM CO., LTD. (JP) 1997-12-16 US claimed
EP-1418047-B1 Planographic printing plate precursor FUJIFILM CORP (JP) 2008-06-11 EP disclosed
US-7358032-B2 Alloy supports having recording multilayers including water insoluble and alkaline soluble polyurethanes, development inhibitors and light to heat conversion dyes, having durability and chemical resistance FUJIFILM CORPORATION (JP) 2008-04-15 US disclosed
US-20080057438-A1 underlayer contains acid-decomposing compound and an acid generator; superior sensitivity, resistance against developer solution (resistance against film thickness loss), aging stability and decreased tint generation KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-03-06 US disclosed
US-20070122743-A1 comprising supports having recording layer including multilayers containing water-insoluble and alkali-soluble resin containing infrared absorbers, development inhibitors that exhibiting enhanced solubility in an aqueous alkali solution through light exposure FUJI PHOTO FILM CO., LTD. 2007-05-31 US disclosed
US-20040101780-A1 Alloy supports having recording multilayers including water insoluble and alkaline soluble polyurethanes, development inhibitors and light to heat conversion dyes, having durability and chemical resistance FUJI PHOTO FILM CO., LTD. 2004-05-27 US disclosed
EP-1418047-A2 Planographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2004-05-12 EP disclosed
US-5698361-A DIAZONIUM COMPOUND, POLYMERIC BINDER; DURABILITY FUJI PHOTO FILM CO., LTD. (JP) 1997-12-16 US disclosed
US-4983491-A LITHOGRAPHIC PRINTING PLATES FUJI PHOTO FILM CO., LTD. 1991-01-08 US disclosed