SCHEMBL5089766

SCHEMBL5089766

Cc1sc2cc(O)ccc2c1C1=C(c2c(C)sc3ccc(O)cc23)C(F)(F)C(F)(F)C1(F)F

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 17/20 0.36
▸ PTPN1 P18031 1/20 0.32
▸ ESR2 Q92731 4/20 0.30
▸ CHEK1 O14757 1/20 0.30
▸ WEE1 P30291 1/20 0.30

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
SCHEMBL2627660 0.94 ESR1 (0.39) ESR1ESR2
SCHEMBL5096571 0.94 CHEK1 (0.33) PTPN1ESR2CHEK1WEE1
SCHEMBL6232707 0.83 ESR1 (0.34) ESR1
SCHEMBL19361388 0.80 BCL2L1 (0.36) ESR1
SCHEMBL5091484 0.79 L3MBTL1 (0.38) —
SCHEMBL20527904 0.77 SMN1; SMN2 (0.40) —
SCHEMBL17212291 0.77 HSD17B10 (0.36) —
SCHEMBL29492999 0.76 GPR3 (0.39) PTPN1
SCHEMBL392860 0.76 GPR3 (0.39) PTPN1
SCHEMBL5087788 0.76 SMN1; SMN2 (0.38) ESR1

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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