SCHEMBL31118

SCHEMBL31118

CCCCCCCCSc1nc(Nc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)nc(SC)n1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 5/20 0.37
▸ PTGS2 P35354 5/20 0.37
▸ CCNE1 P24864 2/20 0.36
▸ CDK2 P24941 2/20 0.36
▸ GPR84 Q9NQS5 7/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ LMNA P02545 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ ALPL P05186 1/20 0.33
▸ PPARG P37231 1/20 0.32
▸ MAPT P10636 1/20 0.32

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
SCHEMBL11702871 0.95 PTGS1 (0.38) PTGS1PTGS2CCNE1CDK2GPR84
SCHEMBL11242060 0.95 PTGS1 (0.38) PTGS1PTGS2CCNE1CDK2GPR84
SCHEMBL38965 0.95 PTGS1 (0.38) PTGS1PTGS2CCNE1CDK2GPR84
SCHEMBL9870699 0.95 PTGS1 (0.38) PTGS1PTGS2CCNE1CDK2GPR84
SCHEMBL11360256 0.95 PTGS1 (0.38) PTGS1PTGS2CCNE1CDK2GPR84
SCHEMBL9120614 0.94 PTGS1 (0.37) PTGS1PTGS2CCNE1CDK2GPR84
SCHEMBL39372 0.93 PTGS1 (0.38) PTGS1PTGS2CCNE1CDK2GPR84
SCHEMBL11364131 0.91 PTGS1 (0.39) PTGS1PTGS2CCNE1CDK2SMN1; SMN2
Propionic Acid SCHEMBL28353142 0.89 PPARG (0.37) PTGS1PTGS2CCNE1CDK2GPR84
SCHEMBL1564869 0.89 CYP1A2 (0.35) PTGS1PTGS2CCNE1CDK2GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11827829-B2 Liquid crystal composition containing dibenzo derivative and liquid crystal display device JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2023-11-28 — — US disclosed
US-20200131440-A1 LIQUID CRYSTAL COMPOSITION AND DISPLAY DEVICE THEREOF JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2020-04-30 — — US disclosed
EP-2714843-B2 LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY DEVICE MERCK PATENT GMBH (DE) 2019-10-30 — — EP disclosed
EP-2542647-B1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2015-09-16 — — EP disclosed
EP-2708587-A1 Liquid crystal medium and liquid crystal display Merck Patent GmbH (DE) 2014-03-19 — — EP disclosed
WO-2012163470-A1 LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2012-12-06 — — WO disclosed
EP-2514800-A2 Compounds and liquid crystalline medium Merck Patent GmbH (DE) 2012-10-24 — — EP disclosed
EP-2508588-A2 Liquid-crystalline medium and liquid-crystal display Merck Patent GmbH (DE) 2012-10-10 — — EP disclosed
WO-2012130380-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2012-10-04 — — WO disclosed
WO-2012126562-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2012-09-27 — — WO disclosed
EP-2239310-A1 Liquid crystal medium and liquid crystal display Merck Patent GmbH (DE) 2010-10-13 — — EP disclosed
WO-2010057575-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2010-05-27 — — WO disclosed
WO-2009156118-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2009-12-30 — — WO disclosed
WO-2009115186-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2009-09-24 — — WO disclosed
WO-2009080261-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2009-07-02 — — WO disclosed
WO-2009033564-A2 ELECTRO-OPTICAL LIGHT CONTROL ELEMENT, ELECTRO-OPTICAL DISPLAY AND CONTROL MEDIUM MERCK PATENT GMBH (DE) 2009-03-19 — — WO disclosed
WO-2009030329-A1 LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2009-03-12 — — WO disclosed
WO-2008145297-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2008-12-04 — — WO disclosed
EP-1959000-A1 Liquid crystalline medium MERCK PATENT GmbH (DE) 2008-08-20 — — EP disclosed
US-7410738-B2 Imaging member having first and second charge transport layers XEROX CORPORATION (US) 2008-08-12 — — US disclosed
Send feedback