SCHEMBL7219057

SCHEMBL7219057

C=CCC(=Cc1ccccc1)CC=C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TSHR P16473 3/20 0.44
AKR1C3 P42330 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
PAM P19021 1/20 0.38
AKR1C1 Q04828 1/20 0.38
ESR1 P03372 1/20 0.38
RECQL P46063 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
FBP1 P09467 3/20 0.35
NR1I2 O75469 1/20 0.35
CYP2C19 P33261 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
SCHEMBL2850505 0.90 ALDH1A1 (0.39) ALDH1A1TSHRAKR1C3CYP3A4CYP2C9
SCHEMBL2850504 0.90 ALDH1A1 (0.39) ALDH1A1TSHRAKR1C3CYP3A4CYP2C9
SCHEMBL7036787 0.86 CYP3A4 (0.49) ALDH1A1TSHRAKR1C3CYP3A4CYP2C9
SCHEMBL433428 0.82 ALDH1A1 (0.44) ALDH1A1TSHRAKR1C3CYP3A4CYP2C9
SCHEMBL3839387 0.82 LMNA (0.47) ALDH1A1TSHRAKR1C3ESR1MEN1
SCHEMBL7696952 0.78 FBP1 (0.41) ALDH1A1TSHRAKR1C3CYP3A4CYP2C9
SCHEMBL7731176 0.78 FBP1 (0.41) ALDH1A1TSHRAKR1C3CYP3A4CYP2C9
SCHEMBL4911765 0.78 ALDH1A1 (0.41) ALDH1A1TSHRAKR1C3CYP3A4CYP2C9
SCHEMBL627745 0.78 TSHR (0.45) ALDH1A1TSHRAKR1C3RECQLMEN1
SCHEMBL10533493 0.78 ALDH1A1 (0.41) ALDH1A1TSHRAKR1C3CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117980461-A Polymer film and method for producing same 皇家飞利浦有限公司 2024-05-03 CN claimed
US-6621684-B2 Improved stability of electrochemical properties and improved retention of residual voltage, imparted by using an electrolytic solution containing a polymer MATSUSHITA ELECTRIC INSUSTRIAL CO. LTD. (JP) 2003-09-16 US disclosed
US-20020036884-A1 Electric double layer capacitor, electrolytic solution therefore and method for suppressing self-discharge in electronic component MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2002-03-28 US disclosed
US-4861742-A Bifunctional alkali metal compounds, preparation and use thereof as polymerization initiators BASF AKTIENGESELLSCHAFT (DE) 1989-08-29 US disclosed