SCHEMBL3911808

SCHEMBL3911808

CCOC(=O)C1=C(Nc2ccccc2)CC(C(=O)OCC)=C(Nc2ccccc2)C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.52
▸ LMNA P02545 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ ACHE P22303 4/20 0.50
▸ ILK Q13418 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ GAA P10253 3/20 0.47
▸ TSHR P16473 1/20 0.47
▸ DHODH Q02127 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ NPY1R P25929 1/20 0.47
▸ NPY2R P49146 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL3909913 0.96 MAPT (0.49) MAPTLMNAMAPK1HSD17B10ACHE
SCHEMBL9327996 0.88 LMNA (0.53) MAPTLMNAMAPK1HSD17B10ACHE
SCHEMBL3905204 0.88 NPC1 (0.47) MAPTLMNAMAPK1HSD17B10ACHE
SCHEMBL3900458 0.85 CASP3 (0.52) MAPTACHEATMSMN1; SMN2ALDH1A1
SCHEMBL9326928 0.85 TSHR (0.53) MAPTLMNAMAPK1HSD17B10NPC1
SCHEMBL9328298 0.84 ALDH1A1 (0.51) MAPTLMNAMAPK1HSD17B10NPC1
SCHEMBL10803715 0.84 MAPT (0.50) MAPTLMNAMAPK1HSD17B10ACHE
SCHEMBL8022715 0.84 MAPT (0.50) MAPTLMNAMAPK1HSD17B10ACHE
SCHEMBL3909905 0.83 MAPT (0.53) MAPTLMNAMAPK1ACHENPC1
SCHEMBL3899773 0.83 GAA (0.50) MAPTACHENPC1HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0235647-B1 PROCESS FOR THE MANUFACTURE OF 6,13-DIHYDROQUINACRIDONES AND QUINACRIDONES BAYER AG (DE) 1993-09-29 — — EP claimed
US-4812568-A Process for the preparation of 6,13-dihydroquinacridones and quinacridones BAYER AKTIENGESELLSCHAFT (DE) 1989-03-14 — — US claimed
EP-0632106-B2 Process for the production of 2,5-di(arylamino)-3,6- dihydroterephthalic acid dialkyl ester, and process for the production of quinacridone from said ester as intermediate TOYO INK MFG CO (JP) 2009-02-25 — — EP disclosed
EP-0632106-B1 Process for the production of 2,5-di(arylamino)-3,6- dihydroterephthalic acid dialkyl ester, and process for the production of quinacridone from said ester as intermediate TOYO INK MFG CO (JP) 2001-08-22 — — EP disclosed
US-5817817-A Process for the production of 2,5-di(arylamino)-3,6-dihydroterephthalic acid dialkyl ester, and process for the production of quinacridone from said ester as intermediate TOYO INK MANUFACTURING CO., LTD. (JP) 1998-10-06 — — US disclosed
EP-0648733-B1 Process for the preparation of intermediates in the quinacridone synthesis CHEMIE LINZ GMBH (AT) 1998-01-21 — — EP disclosed
US-5659036-A Process for the production of 2,5-di(arylamino)-3,6-dihydroterephthalic acid dialkyl ester, and process for the production of quinacridone from said ester as intermediate TOYO INK MANUFACTURING CO., LTD. (JP) 1997-08-19 — — US disclosed
US-5659076-A Process for the production of 2,5-dianilino-terephthalic acids DSM CHEMIE LINZ GMBH (AT) 1997-08-19 — — US disclosed
US-5491255-A Process for the transesterification of dimethyl succinylsuccinate CHEMIE LINZ GMBH (AT) 1996-02-13 — — US disclosed
EP-0648733-A2 Quinacridone synthesis and process for preparation of intermediates DSM Chemie Linz GmbH (AT) 1995-04-19 — — EP disclosed
EP-0632106-A1 Process for the production of 2,5-di(arylamino)-3,6- dihydroterephthalic acid dialkyl ester, and process for the production of quinacridone from said ester as intermediate TOYO INK MANUFACTURING CO., LTD. (JP) 1995-01-04 — — EP disclosed
EP-0313965-B1 Process for the manufacture of dihydroquinacridones, of quinacridones and of quinacridone quinones BASF AG (DE) 1994-03-16 — — EP disclosed
EP-0363756-B1 METHOD FOR THE PREPARATION OF 2,5-DIARYLAMINO-TEREPHTHALIC ACIDS BAYER AG (DE) 1992-12-02 — — EP disclosed
US-4981997-A Process for the preparation of 2,5-diarylaminoterephthalic acids BAYER AKTIENGESELLSCHAFT (DE) 1991-01-01 — — US disclosed
US-4956464-A Cyclization, dehydrogenation in the vapor phase or solid phase in the presence of an oxidizer BASF AKTIENGESELLSCHAFT (DE) 1990-09-11 — — US disclosed
EP-0313965-A2 Process for the manufacture of dihydroquinacridones, of quinacridones and of quinacridone quinones BASF Aktiengesellschaft (DE) 1989-05-03 — — EP disclosed
US-4812568-A Process for the preparation of 6,13-dihydroquinacridones and quinacridones BAYER AKTIENGESELLSCHAFT (DE) 1989-03-14 — — US disclosed
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