SCHEMBL5012463

SCHEMBL5012463

c1ccc(C(c2ccccc2)(c2ccccc2)c2cccc3ccccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 1/20 0.46
HSD17B10 Q99714 6/20 0.44
CYP1A2 P05177 5/20 0.44
HPGD P15428 4/20 0.44
CYP2C19 P33261 3/20 0.44
HIF1A Q16665 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2D6 P10635 1/20 0.44
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43
NR4A3 Q92570 1/20 0.43
KIF11 P52732 1/20 0.43
ALDH1A1 P00352 7/20 0.42
TSHR P16473 4/20 0.42
CYP2A6 P11509 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP3A4 P08684 3/20 0.39
KEAP1 Q14145 1/20 0.39
CFTR P13569 1/20 0.39
GOPC Q9HD26 1/20 0.39

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
SCHEMBL28108200 0.95 ACP3 (0.46) ACP3HSD17B10CYP1A2HPGDCYP2C19
SCHEMBL7028514 0.80 KIF11 (0.45) ACP3HSD17B10CYP1A2HPGDCYP2C19
SCHEMBL2187746 0.80 HSD17B10 (0.43) ACP3HSD17B10CYP1A2HPGDCYP2C19
SCHEMBL6242753 0.78 CYP1A2 (0.42) ACP3HSD17B10CYP1A2HPGDCYP2C19
SCHEMBL3003485 0.78 CYP3A4 (0.42) ACP3HSD17B10CYP1A2HPGDCYP2C19
SCHEMBL648242 0.78 HSD17B10 (0.42) ACP3HSD17B10CYP1A2HPGDCYP2C19
SCHEMBL2355481 0.78 CYP1A2 (0.59) ACP3HSD17B10CYP1A2HPGDCYP2C19
SCHEMBL5013862 0.78 TSHR (0.42) ACP3HSD17B10CYP1A2HPGDCYP2C19
SCHEMBL15212262 0.78 HSD17B10 (0.42) ACP3HSD17B10CYP1A2HPGDCYP2C19
SCHEMBL6241697 0.78 CYP1A2 (0.42) ACP3HSD17B10CYP1A2HPGDCYP2C19

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
US-11685702-B2 Method for producing arene compounds and arene compounds produced by the same JSI SILICONE CO. (KR) 2023-06-27 US disclosed
US-20210188739-A1 METHOD FOR PRODUCING ARENE COMPOUNDS AND ARENE COMPOUNDS PRODUCED BY THE SAME JSI SILICONE CO. (KR) 2021-06-24 US disclosed
CN-101218299-B Fine particle-dispersed polyol composition, method for producing polymer polyol, and method for producing polyurethane resin SANYO CHEMICAL IND LTD 2012-06-20 CN disclosed
CN-101253249-B Thermosetting solvent-free single-component substances and use thereof DELO INDUSTRIEKLEBSTOFFE GMBH 2012-06-06 CN disclosed
CN-102276973-A Method for producing polymer polyol, and method for producing polyurethane resin 2011-12-14 CN disclosed
CN-101802045-A Polyurethane and polyurea, and method for producing the same TOYOTA JIDOSHOKKI KK 2010-08-11 CN disclosed
US-20080207864-A1 Organosilanes, Process For Production of the Same, and Use Thereof SHARP KABUSHIKI KAISHA (JP) 2008-08-28 US disclosed
CN-101218299-A Fine particle-dispersed polyol composition, method for producing polymer polyol, and method for producing polyurethane resin SANYO CHEMICAL IND LTD (JP) 2008-07-09 CN disclosed
US-6013656-A PSYCHOLOGICAL DISORDERS; GASTROINTESTINAL DISORDERS; NERVOUSSYSTEM DISORDERS WARNER-LAMBERT COMPANY (US) 2000-01-11 US disclosed
US-5849760-A 2-(arylalkenyl)azacycloalkane derivatives as ligands for sigma receptors INSTITUT DE RECHERCHE JOUVEINAL (FR) 1998-12-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210188739-A1 METHOD FOR PRODUCING ARENE COMPOUNDS AND ARENE COMPOUNDS PRODUCED BY THE SAME PFAS, FRK, AGPAT2 ACP3 399/4885HSD17B10 1306/4885CYP1A2 303/4885
US-11685702-B2 Method for producing arene compounds and arene compounds produced by the same PFAS, FRK, AGPAT2 ACP3 399/4885HSD17B10 1306/4885CYP1A2 303/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.