SCHEMBL10090595

SCHEMBL10090595

Cc1cccc(-c2ccc(N(c3ccc(-c4cccc(C)c4)cc3)c3ccc(C)cc3C)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 3/20 0.43
▸ HSD17B2 P37059 3/20 0.43
▸ MAPT P10636 1/20 0.40
▸ ENPP3 O14638 2/20 0.40
▸ PGR P06401 1/20 0.37
▸ ACHE P22303 1/20 0.35
▸ FNTA P49354 1/20 0.35
▸ FNTB P49356 1/20 0.35
▸ NISCH Q9Y2I1 1/20 0.35
▸ CHRNB4 P30926 1/20 0.35
▸ CHRNA3 P32297 1/20 0.35
▸ MAP4K4 O95819 1/20 0.35
▸ AR P10275 1/20 0.35
▸ FYN P06241 1/20 0.35
▸ CLK4 Q9HAZ1 1/20 0.35
▸ DYRK1B Q9Y463 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35

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
SCHEMBL13241986 0.93 HSD17B1 (0.40) HSD17B1HSD17B2ENPP3PGRACHE
SCHEMBL15946725 0.90 SMN1; SMN2 (0.41) MAPT
SCHEMBL14423299 0.90 SMN1; SMN2 (0.41) MAPT
SCHEMBL14724014 0.88 RAB9A (0.40) MAPT
SCHEMBL19607550 0.88 ALDH1A1 (0.38) HSD17B1HSD17B2MAPTACHE
SCHEMBL13497433 0.88 ALDH1A1 (0.38) HSD17B1HSD17B2MAPTACHE
SCHEMBL21676490 0.88 ALDH1A1 (0.38) HSD17B1HSD17B2MAPTACHE
SCHEMBL13929904 0.88 ALDH1A1 (0.38) HSD17B1HSD17B2MAPTACHE
SCHEMBL13497435 0.88 ALDH1A1 (0.38) HSD17B1HSD17B2MAPTACHE
SCHEMBL13136840 0.87 HSD17B1 (0.41) HSD17B1HSD17B2ENPP3ACHESIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170162805-A1 EXTENDED NON-LINEAR ACENE DERIVATIVES AND THEIR USE AS ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2017-06-08 — — US disclosed
US-9373801-B2 Flavanthrene derivatives and their use as organic semiconductors MERCK PATENT GMBH (DE) 2016-06-21 — — US disclosed
US-9306172-B2 Anthra[2,3-b:7,6-b']dithiophene derivatives and their use as organic semiconductors MERCK PATENT GMBH (DE) 2016-04-05 — — US disclosed
US-9306172-B2 Anthra[2,3-b:7,6-b']dithiophene derivatives and their use as organic semiconductors MERCK PATENT GMBH (DE) 2016-04-05 — — US disclosed
US-9236574-B2 Dinaphto[2,3-a:2′3′-H]phenazines and their use as organic semiconductors MERCK PATENT GMBH (DE) 2016-01-12 — — US disclosed
US-9236574-B2 Dinaphto[2,3-a:2′3′-H]phenazines and their use as organic semiconductors MERCK PATENT GMBH (DE) 2016-01-12 — — US disclosed
US-20150155494-A1 ORGANIC ELECTRONIC DEVICE COMPRISING AN ORGANIC SEMICONDUCTORS FORMULATION MERCK PATENT GMBH (DE) 2015-06-04 — — US disclosed
US-20150155494-A1 ORGANIC ELECTRONIC DEVICE COMPRISING AN ORGANIC SEMICONDUCTORS FORMULATION MERCK PATENT GMBH (DE) 2015-06-04 — — US disclosed
US-20150108409-A1 SMALL MOLECULES AND THEIR USE AS ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2015-04-23 — — US disclosed
US-20150108409-A1 SMALL MOLECULES AND THEIR USE AS ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2015-04-23 — — US disclosed
US-7576208-B2 Organic semiconductor layers MERCK PATENT GMBH (DE) 2009-08-18 — — US disclosed
US-20080197325-A1 Oligomeric Polyacene and Semiconductor Formulations MERCK PATENT GMBH (DE) 2008-08-21 — — US disclosed
US-20080197325-A1 Oligomeric Polyacene and Semiconductor Formulations MERCK PATENT GMBH (DE) 2008-08-21 — — US disclosed
US-20080191199-A1 Polyacene and Semiconductor Formulation FLEXENABLE TECHNOLOGY LIMITED (GB) 2008-08-14 — — US disclosed
US-20080191199-A1 Polyacene and Semiconductor Formulation FLEXENABLE TECHNOLOGY LIMITED (GB) 2008-08-14 — — US disclosed
US-20080009625-A1 6,13-bis(triisopropylsilylethynyl)pentacene, use in in various electronic devices and in a formulation for ink jet printing and in an organic field effect transistors FLEXENABLE TECHNOLOGY LIMITED (GB) 2008-01-10 — — US disclosed
US-20070137520-A1 ORGANIC SEMICONDUCTING LAYERS FLEXENABLE TECHNOLOGY LIMITED (GB) 2007-06-21 — — US disclosed
US-20070102696-A1 Organic semiconducting layers FLEXENABLE TECHNOLOGY LIMITED (GB) 2007-05-10 — — US disclosed
US-7214457-B2 Organic photoconductor, process cartridge, image forming apparatus and image forming method KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2007-05-08 — — US disclosed
US-7214457-B2 Organic photoconductor, process cartridge, image forming apparatus and image forming method KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2007-05-08 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080009625-A1 6,13-bis(triisopropylsilylethynyl)pentacene, use in in various electronic devices and in a formulation for ink jet printing and in an organic field effect transistors OR10J3, RCOR3, H1-10 HSD17B1 3177/4885HSD17B2 3188/4885MAPT 3862/4885
US-20080191199-A1 Polyacene and Semiconductor Formulation OR51E2, PIEZO1, FDFT1 HSD17B1 4395/4885HSD17B2 4238/4885MAPT 661/4885
US-20170162805-A1 EXTENDED NON-LINEAR ACENE DERIVATIVES AND THEIR USE AS ORGANIC SEMICONDUCTORS ACE, ACE2, ECE2 HSD17B1 1283/4885HSD17B2 902/4885MAPT 1762/4885
US-20070102696-A1 Organic semiconducting layers SSB, RCOR3, CNKSR1 HSD17B1 3183/4885HSD17B2 2731/4885MAPT 4332/4885
US-20080197325-A1 Oligomeric Polyacene and Semiconductor Formulations OR51E2, OR10J3, OSTC HSD17B1 4332/4885HSD17B2 4176/4885MAPT 244/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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