SCHEMBL7034834

SCHEMBL7034834

C=CCC(=C)c1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.52
MAOB P27338 3/20 0.52
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
GSK3B P49841 2/20 0.39
TSHR P16473 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALOX15 P16050 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPK1 P28482 1/20 0.38
ATM Q13315 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37

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
SCHEMBL9678332 0.89 MAOA (0.35) MAOAMAOBMAPT
SCHEMBL10457849 0.80 MAPT (0.48) TSHRALOX15CYP3A4MAPK1KDM4E
SCHEMBL17868851 0.78 TPMT (0.38) MAOAMAOBGSK3BCA1CA2
SCHEMBL5134898 0.78 MAOA (0.41) MAOAMAOBCES2CES1GSK3B
SCHEMBL17868843 0.78 MAOA (0.52) MAOAMAOBCES2CES1CA1
SCHEMBL11015525 0.78 ALDH1A1 (0.40) CES2CES1GSK3BATMALDH1A1
SCHEMBL10457452 0.78 MASP2 (0.38) MAOAMAOBCYP3A4KDM4ELMNA
SCHEMBL30680 0.77 MAOA (0.48) MAOAMAOBALDH1A1LMNA
SCHEMBL3433300 0.77 TSHR (0.50) CES2CES1TSHRL3MBTL1ALOX15
SCHEMBL3415923 0.77 GSK3B (0.57) CES2CES1GSK3BTSHRL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115784862-A Method for preparing 3-hydroxypropionaldehyde by acrolein hydration 万华化学集团股份有限公司 2023-03-14 CN disclosed
US-10330840-B2 Optical film LG CHEM, LTD. (KR) 2019-06-25 US disclosed
EP-3086145-B1 OPTICAL FILM LG CHEMICAL LTD (KR) 2018-12-05 EP disclosed
EP-3086145-A1 OPTICAL FILM LG Chem, Ltd. (KR) 2016-10-26 EP disclosed
US-20160280966-A1 OPTICAL FILM LG CHEM, LTD. (KR) 2016-09-29 US disclosed
US-20160186217-A1 METHOD FOR BIOCATALYTIC SYNTHESIS OF SUBSTITUTED OR UNSUBSTITUTED PHENYLACETIC ACIDS AND KETONES HAVING ENZYMES OF MICROBIAL STYRENE DEGRADATION TECHNISCHE UNIVERSITAT BERGAKADEMIE FREIBERG (DE) 2016-06-30 US disclosed
US-6767687-B1 CAN FORM FINER PATTERNS ON A SUBSTRATE IN A MICRO-LITHOGRAPHY PROCESS SUITABLE FOR MICRO-PROCESSING OF SEMICONDUCTORS DONGJIN SEMICHEM CO., LTD. (KR) 2004-07-27 US disclosed
US-20030181629-A1 Chemically amplified resist and a resist composition DONGJIN SEMICHEM CO., LTD. (KR) 2003-09-25 US disclosed
WO-2001018603-A2 POLYMER FOR CHEMICALLY AMPLIFIED RESIST AND A RESIST COMPOSITION USING THE SAME DONGJIN SEMICHEM CO., LTD. (KR) 2001-03-15 WO disclosed