SCHEMBL6761989

SCHEMBL6761989

c1ccc(-c2ccc([PH](c3ccc(-c4ccccc4)cc3)(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.56
▸ TAAR1 Q96RJ0 3/20 0.48
▸ CYP1A2 P05177 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ MMP3 P08254 1/20 0.48
▸ BCL2L1 Q07817 1/20 0.48
▸ CA1 P00915 2/20 0.42
▸ CA2 P00918 2/20 0.42
▸ MGLL Q99685 1/20 0.42
▸ KIF11 P52732 1/20 0.42
▸ NOTUM Q6P988 1/20 0.41
▸ ALOX5 P09917 1/20 0.40
▸ CYP1A1 P04798 1/20 0.39
▸ CYP1B1 Q16678 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ MAPT P10636 1/20 0.39

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
SCHEMBL15889318 0.97 ALDH1A1 (0.53) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
SCHEMBL15889317 0.97 ALDH1A1 (0.53) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
SCHEMBL11057086 0.97 ALDH1A1 (0.53) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4
Phenol SCHEMBL27381582 0.85 MMP3 (0.61) ALDH1A1CYP3A4HSD17B10TDP1MMP3
SCHEMBL9064400 0.83 ALDH1A1 (0.38) ALDH1A1MAPK1CYP3A4HSD17B10TDP1
SCHEMBL12885454 0.82 ALDH1A1 (0.64) ALDH1A1CYP1A2MAPK1TDP1CA2
SCHEMBL28748541 0.79 ALDH1A1 (0.40) ALDH1A1MAPK1CYP3A4HSD17B10TDP1
Benzene SCHEMBL28207368 0.79 ALDH1A1 (0.40) ALDH1A1MAPK1CYP3A4HSD17B10TDP1
SCHEMBL26674 0.79 ALDH1A1 (0.40) ALDH1A1MAPK1CYP3A4HSD17B10TDP1
SCHEMBL18674172 0.79 ALDH1A1 (0.90) ALDH1A1TAAR1CYP1A2MAPK1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114437672-A Ultra-high temperature heat conduction oil based on non-proton type ionic liquid and preparation method thereof 四川大学 2022-05-06 — — CN disclosed
US-20180081272-A1 THERMAL CROSSLINKING ACCELERATOR, POLYSILOXANE-CONTAINING RESIST UNDERLAYER FILM FORMING COMPOSITION CONTAINING SAME, AND PATTERNING PROCESS USING SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-03-22 — — US disclosed
US-20140205951-A1 THERMAL CROSSLINKING ACCELERATOR, POLYSILOXANE-CONTAINING RESIST UNDERLAYER FILM FORMING COMPOSITION CONTAINING SAME, AND PATTERNING PROCESS USING SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-07-24 — — US disclosed
US-20140205951-A1 THERMAL CROSSLINKING ACCELERATOR, POLYSILOXANE-CONTAINING RESIST UNDERLAYER FILM FORMING COMPOSITION CONTAINING SAME, AND PATTERNING PROCESS USING SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-07-24 — — US disclosed
US-6797802-B2 Method of polycarbonate preparation GENERAL ELECTRIC COMPANY 2004-09-28 — — US disclosed
US-20040068087-A1 METHOD OF POLYCARBONATE PREPARATION GENERAL ELECTRIC COMPANY 2004-04-08 — — US disclosed
WO-2003038005-A2 POLYMERIZABLE COMPOSITIONS IN NON-FLOWABLE FORMS HENKEL CORPORATION (US) 2003-05-08 — — WO disclosed
EP-0072157-B1 NOVEL ORGANIC SALT COMPOSITIONS IN EXTRACTION PROCESSES EXXON RESEARCH AND ENGINEERING COMPANY (US) 1986-10-01 — — EP disclosed
US-4440634-A Organic salt compositions in extraction processes EXXON RESEARCH AND ENGINEERING CO. (US) 1984-04-03 — — US disclosed
US-4422975-A Organic salt compositions in extraction processes EXXON RESEARCH AND ENGINEERING CO. (US) 1983-12-27 — — US disclosed
EP-0072157-A2 Novel organic salt compositions in extraction processes EXXON RESEARCH AND ENGINEERING COMPANY (US) 1983-02-16 — — EP disclosed
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