SCHEMBL5091484

SCHEMBL5091484

COc1ccc2c(C3=C(c4c(C)sc5ccc(OC)cc45)C(F)(F)C(F)(F)C3(F)F)c(C)sc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 5/20 0.38
▸ KDM4E B2RXH2 4/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ MAPT P10636 4/20 0.38
▸ TDP1 Q9NUW8 3/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ TSHR P16473 2/20 0.36
▸ PRNP P04156 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ MAPK10 P53779 1/20 0.36
▸ NCOA2 Q15596 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.35
▸ CES2 O00748 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ GAA P10253 1/20 0.34

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
SCHEMBL5091528 0.95 TSHR (0.39) KDM4EALDH1A1MAPTTDP1TSHR
SCHEMBL5090816 0.95 L3MBTL1 (0.41) L3MBTL1KDM4EALDH1A1MAPTTDP1
SCHEMBL5089716 0.87 PRNP (0.36) KDM4EALDH1A1MAPTTSHRPRNP
SCHEMBL17212279 0.84 ALDH1A1 (0.37) KDM4EALDH1A1MAPTTSHRPRNP
SCHEMBL3855911 0.81 RELA (0.41) KDM4EALDH1A1TSHRLMNATUBB4A
SCHEMBL3855910 0.81 RELA (0.41) KDM4EALDH1A1TSHRLMNATUBB4A
SCHEMBL3855184 0.80 RELA (0.36) KDM4EALDH1A1TSHRLMNATUBB4A
SCHEMBL3855182 0.80 RELA (0.36) KDM4EALDH1A1MAPTTDP1TSHR
SCHEMBL5089766 0.79 ESR1 (0.36) —
SCHEMBL19361388 0.78 BCL2L1 (0.36) MAPTNPC1RAB9ALMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7416682-B2 Photochromic liquid crystals CHI MEI OPTOELECTRONICS CORPORATION (TW) 2008-08-26 — — US disclosed
EP-1517977-B1 PHOTOCHROMIC LIQUID CRYSTALS QINETIQ LTD (GB) 2006-10-11 — — EP disclosed
US-20050258396-A1 Potochromic liquid crystals QINETIQ LIMITED (GB) 2005-11-24 — — US disclosed
EP-1517977-A1 PHOTOCHROMIC LIQUID CRYSTALS Qinetiq Limited (GB) 2005-03-30 — — EP disclosed
WO-2004003107-A1 POTOCHROMIC LIQUID CRYSTALS QINETIQ LIMITED (GB) 2004-01-08 — — WO disclosed
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