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SCHEMBL2245873

SCHEMBL2245873

Cc1cccc(N(c2ccc(O)cc2)c2ccc(-c3ccc(N(c4ccc(O)cc4)c4cccc(C)c4)cc3)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 4/20 0.45
▸ HSD17B1 P14061 4/20 0.45
▸ HSD17B2 P37059 4/20 0.45
▸ ACHE P22303 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ ESR2 Q92731 3/20 0.40
▸ ABL1 P00519 1/20 0.40
▸ ABCB1 P08183 1/20 0.40
▸ BCR P11274 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ APP P05067 1/20 0.40
▸ MMP3 P08254 1/20 0.39
▸ BCL2L1 Q07817 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ RAB9A P51151 1/20 0.38

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
SCHEMBL10064828 0.97 MMP3 (0.45) ESR1HSD17B1HSD17B2ACHEMEN1
SCHEMBL22942236 0.97 CYP1A2 (0.45) ESR1HSD17B1HSD17B2ACHEMEN1
SCHEMBL15315168 0.97 MMP3 (0.45) ESR1HSD17B1HSD17B2ACHEMEN1
SCHEMBL12268827 0.97 MMP3 (0.45) ESR1HSD17B1HSD17B2ACHEMEN1
SCHEMBL7650549 0.94 ACHE (0.50) ESR1HSD17B1HSD17B2ACHEMEN1
SCHEMBL19192998 0.91 ACHE (0.53) HSD17B1HSD17B2ACHECYP1A2CYP2C19
SCHEMBL4098035 0.91 HSD17B1 (0.47) HSD17B1HSD17B2ACHEMEN1KMT2A
SCHEMBL13809109 0.91 HSD17B1 (0.47) HSD17B1HSD17B2ACHEMEN1KMT2A
SCHEMBL12084500 0.90 HSD17B1 (0.43) ESR1HSD17B1HSD17B2ACHEMEN1
SCHEMBL2609916 0.88 ACHE (0.50) HSD17B1HSD17B2ACHECYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7807324-B2 Photoconductors XEROX CORPORATION (US) 2010-10-05 — — US claimed
US-20080070136-A1 Photoconductors XEROX CORPORATION 2008-03-20 — — US claimed
US-8450033-B2 Electrography; facsimiles, printers, copiers; polyurethanes RICOH COMPANY, LTD. (JP) 2013-05-28 — — US disclosed
US-8450033-B2 Electrography; facsimiles, printers, copiers; polyurethanes RICOH COMPANY, LTD. (JP) 2013-05-28 — — US disclosed
US-8008418-B2 High-molecular copolymer containing metal coordination compound and organic electroluminescence element using the same HITACHI CHEMICAL CO., LTD. (JP) 2011-08-30 — — US disclosed
US-7807324-B2 Photoconductors XEROX CORPORATION (US) 2010-10-05 — — US disclosed
US-20080138728-A1 LATENT ELECTROSTATIC IMAGE BEARING MEMBER, AND IMAGE FORMING APPARATUS, IMAGE FORMING METHOD AND PROCESS CARTRIDGE USING THE SAME RICOH COMPANY, LTD. (JP) 2008-06-12 — — US disclosed
US-20080138728-A1 LATENT ELECTROSTATIC IMAGE BEARING MEMBER, AND IMAGE FORMING APPARATUS, IMAGE FORMING METHOD AND PROCESS CARTRIDGE USING THE SAME RICOH COMPANY, LTD. (JP) 2008-06-12 — — US disclosed
US-20080070136-A1 Photoconductors XEROX CORPORATION 2008-03-20 — — US disclosed
US-20070027299-A1 Quinoline copolymer having branced structure and organic electroluminescent device employing same HITACHI CHEMICAL CO., LTD. (JP) 2007-02-01 — — US disclosed
US-20070003783-A1 Quinoline copolymer and organic electroluminescent device employing same HITACHI CHEMICAL CO LTD (JP) 2007-01-04 — — US disclosed
US-20060287498-A1 High-molecular copolymer containing metal coordination compound and organic electroluminescence element using the same HITACHI CHEMICAL CO LTD (JP) 2006-12-21 — — US disclosed