SCHEMBL182732

SCHEMBL182732

CCCCC(=CC(C=CC#N)=Cc1ccccc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
ALOX5 P09917 5/20 0.41
PTGES O14684 3/20 0.41
PPARG P37231 2/20 0.41
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
APEX1 P27695 1/20 0.36
ELANE P08246 1/20 0.35
AKR1C3 P42330 1/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
TSHR P16473 1/20 0.34
EGFR P00533 1/20 0.34
HDAC3 O15379 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
PSEN1 P49768 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
SCHEMBL11419748 0.96 LMNA (0.48) LMNATDP1ALOX5PTGESPPARG
SCHEMBL2785101 0.87 CYP3A4 (0.41) LMNAPPARGCYP3A4CYP2C9AKR1C3
SCHEMBL5249714 0.86 LMNA (0.53) LMNATDP1ALOX5PTGESPPARG
SCHEMBL2042270 0.82 LMNA (0.49) LMNATDP1ALOX5PTGESPPARG
SCHEMBL16823376 0.81 CYP3A4 (0.38) LMNATDP1CYP3A4CYP2C9AKR1C3
SCHEMBL9785974 0.81 LMNA (0.48) LMNATDP1ALOX5PTGESPPARG
SCHEMBL3082168 0.81 LMNA (0.48) LMNATDP1ALOX5PTGESPPARG
SCHEMBL4324631 0.81 HDAC3 (0.42) LMNATDP1ALOX5PTGESPPARG
SCHEMBL10685052 0.80 TDP1 (0.60) LMNATDP1ALOX5PTGESPPARG
SCHEMBL10783753 0.80 AKR1C3 (0.49) LMNATDP1ALOX5PTGESPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012012763-A4 SLIDER AND HISTORY FIELD FOR SMART CHAT SESSIONS 24/7 CUSTOMER, INC. (US) 2012-05-18 WO claimed
EP-1812637-B1 COMPOSITE THERMOPLASTIC SHEETS INCLUDING NATURAL FIBERS AZDEL INC (US) 2012-01-04 EP claimed
US-10087297-B2 Self-extinguishing polymeric composition Versalis, S.P.A. (IT) 2018-10-02 US disclosed
EP-2920241-B1 SELF-EXTINGUISHING POLYMERIC COMPOSITION VERSALIS SPA (IT) 2017-10-25 EP disclosed
EP-2922917-B1 SELF-EXTINGUISHING POLYMERIC COMPOSITION VERSALIS SPA (IT) 2017-01-04 EP disclosed
US-20150299410-A1 SELF-EXTINGUISHING POLYMERIC COMPOSITION VERSALIS S.P.A. (IT) 2015-10-22 US disclosed
EP-2922917-A1 SELF-EXTINGUISHING POLYMERIC COMPOSITION Versalis S.p.A (IT) 2015-09-30 EP disclosed
EP-2920241-A1 SELF-EXTINGUISHING POLYMERIC COMPOSITION Versalis S.p.A (IT) 2015-09-23 EP disclosed
WO-2014080326-A1 SELF-EXTINGUISHING POLYMERIC COMPOSITION VERSALIS S.P.A (IT) 2014-05-30 WO disclosed
WO-2014076644-A1 SELF-EXTINGUISHING POLYMERIC COMPOSITION VERSALIS S.P.A (IT) 2014-05-22 WO disclosed