SCHEMBL7918673

SCHEMBL7918673

O=c1ccccc2ccc3ccccc3c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 3/20 0.56
HSD17B10 Q99714 4/20 0.52
ALDH1A1 P00352 3/20 0.52
TDP1 Q9NUW8 3/20 0.52
TSHR P16473 2/20 0.52
CYP2A6 P11509 1/20 0.52
CYP1A2 P05177 2/20 0.50
HPGD P15428 2/20 0.50
THRB P10828 1/20 0.50
HPRT1 P00492 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
AHR P35869 3/20 0.46
ABCG2 Q9UNQ0 2/20 0.46
CYP1A1 P04798 1/20 0.46
FYN P06241 1/20 0.46
MAPK3 P27361 1/20 0.46
HIF1A Q16665 2/20 0.45
RAB9A P51151 2/20 0.45
CYP3A4 P08684 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL29487823 0.81 HSD17B10 (0.72) PAX8HSD17B10ALDH1A1TDP1TSHR
SCHEMBL30374792 0.81 HSD17B10 (0.69) PAX8HSD17B10ALDH1A1TDP1TSHR
SCHEMBL535472 0.81 HSD17B10 (0.72) PAX8HSD17B10ALDH1A1TDP1TSHR
SCHEMBL535635 0.81 HSD17B10 (0.69) PAX8HSD17B10ALDH1A1TDP1TSHR
SCHEMBL29388002 0.81 HSD17B10 (0.69) PAX8HSD17B10ALDH1A1TDP1TSHR
SCHEMBL29613365 0.81 HSD17B10 (0.72) PAX8HSD17B10ALDH1A1TDP1TSHR
SCHEMBL4851942 0.78 HSD17B10 (0.68) PAX8HSD17B10ALDH1A1TDP1TSHR
SCHEMBL3707219 0.78 PAX8 (0.67) PAX8HSD17B10ALDH1A1TDP1TSHR
SCHEMBL29569839 0.78 HSD17B10 (0.68) PAX8HSD17B10ALDH1A1TDP1TSHR
SCHEMBL29569119 0.78 HSD17B10 (0.68) PAX8HSD17B10ALDH1A1TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0872903-B1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder SHINETSU CHEMICAL CO (JP) 2001-10-04 EP disclosed
US-6277519-B1 QUENCHING AN ALLOY MELT; COMMINUTION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
US-6096144-A TREATING WITH ACIDIC OR ALKALINE SOLUTION OF CONJUGATED UNSATURATED COMPOUND WITH AT LEAST 5 BONDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-08-01 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 EP disclosed