SCHEMBL116992

SCHEMBL116992

C=CC(=O)OCCCCCCCCCCOC(=O)c1c2ccccc2cc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 15/20 0.53
ABCG2 Q9UNQ0 12/20 0.53
ALDH1A1 P00352 1/20 0.51
CYP3A4 P08684 1/20 0.51
TSHR P16473 1/20 0.51
CA12 O43570 3/20 0.47
CA9 Q16790 3/20 0.47
THRB P10828 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
SCHEMBL14440746 0.93 THRB (0.51) ABCB1ABCG2ALDH1A1CYP3A4TSHR
SCHEMBL16281737 0.87 ABCB1 (0.46) ABCB1ABCG2ALDH1A1CA12CA9
SCHEMBL28989662 0.84 TSHR (0.51) ABCB1ABCG2ALDH1A1CYP3A4TSHR
SCHEMBL3404137 0.83 ABCB1 (0.53) ABCB1ABCG2CA12CA9
SCHEMBL28989641 0.82 THRB (0.49) ABCB1ABCG2ALDH1A1CYP3A4TSHR
Ammonia Solution, Strong SCHEMBL15940166 0.81 TSHR (0.59) ABCB1ABCG2ALDH1A1CYP3A4TSHR
SCHEMBL4632462 0.81 CA12 (0.49) ABCB1ABCG2ALDH1A1CA12CA9
SCHEMBL9731268 0.81 CA12 (0.49) ABCB1ABCG2ALDH1A1CA12CA9
SCHEMBL4633422 0.81 CA12 (0.49) ABCB1ABCG2ALDH1A1CA12CA9
SCHEMBL29503776 0.81 THRB (0.50) ABCB1ALDH1A1CYP3A4TSHRTHRB

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 160 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2202083-B1 Image forming apparatus, image forming method, remote monitoring system, and method of providing maintenance service FUJIFILM CORP (JP) 2018-01-31 EP disclosed
EP-2474581-B1 INK SET, RECORDING METHOD, RECORDED MATERIAL, AND PRINTED MATERIAL FUJIFILM CORP (JP) 2017-11-29 EP disclosed
EP-2230279-B1 METHOD FOR MANUFACTURING PIGMENT DISPERSION, AND AQUEOUS INK FOR INKJET RECORDING FUJIFILM CORP (JP) 2017-09-20 EP disclosed
EP-2218757-B1 Ink composition FUJIFILM CORP (JP) 2017-09-06 EP disclosed
US-9714356-B2 Black ink composition, ink set, and image forming method FUJIFILM CORPORATION (JP) 2017-07-25 US disclosed
US-9714356-B2 Black ink composition, ink set, and image forming method FUJIFILM CORPORATION (JP) 2017-07-25 US disclosed
US-9133359-B2 Maintenance liquid for inkjet recording, ink set for inkjet recording, image forming method, and maintenance method FUJIFILM CORPORATION (JP) 2015-09-15 US disclosed
US-9133359-B2 Maintenance liquid for inkjet recording, ink set for inkjet recording, image forming method, and maintenance method FUJIFILM CORPORATION (JP) 2015-09-15 US disclosed
EP-2298555-B1 Image forming method and ink composition FUJIFILM CORP (JP) 2015-08-26 EP disclosed
EP-2058375-B1 Pigment composition, water-based pigment dispersion, method of producing water-based pigment dispersion, water-based ink for ink jet recording, and polymer compound FUJIFILM CORP (JP) 2015-08-19 EP disclosed
EP-2090625-A2 Aqueous inkjet recording ink FUJIFILM Corporation (JP) 2009-08-19 EP disclosed
US-20090202724-A1 INK COMPOSITION, INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2009-08-13 US disclosed
US-20090202724-A1 INK COMPOSITION, INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2009-08-13 US disclosed
US-20090203833-A1 AQEOUS INKJET RECORDING INK FUJIFILM CORPORATION (JP) 2009-08-13 US disclosed
US-20090203833-A1 AQEOUS INKJET RECORDING INK FUJIFILM CORPORATION (JP) 2009-08-13 US disclosed
US-20090131577-A1 PIGMENT COMPOSITION, WATER-BASED PIGMENT DISPERSION, METHOD OF PRODUCING WATER-BASED PIGMENT DISPERSION, WATER-BASED INK FOR INK JET RECORDING, AND POLYMER COMPOUND FUJIFILM CORPORATION (JP) 2009-05-21 US disclosed
US-20090131577-A1 PIGMENT COMPOSITION, WATER-BASED PIGMENT DISPERSION, METHOD OF PRODUCING WATER-BASED PIGMENT DISPERSION, WATER-BASED INK FOR INK JET RECORDING, AND POLYMER COMPOUND FUJIFILM CORPORATION (JP) 2009-05-21 US disclosed
EP-2058375-A2 Pigment composition, water-based pigment dispersion, method of producing water-based pigment dispersion, water-based ink for ink jet recording, and polymer compound FUJIFILM Corporation (JP) 2009-05-13 EP disclosed
US-20090079784-A1 IMAGE FORMING METHOD AND APPARATUS FUJIFILM CORPORATION (JP) 2009-03-26 US disclosed
US-20090079784-A1 IMAGE FORMING METHOD AND APPARATUS FUJIFILM CORPORATION (JP) 2009-03-26 US disclosed