SCHEMBL2422652

SCHEMBL2422652

C=C1COc2ccccc2O1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 1/20 0.46
ITGB2 P05107 1/20 0.46
ICAM1 P05362 1/20 0.46
ITGAL P20701 1/20 0.46
LMNA P02545 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
CRHBP P24387 2/20 0.41
CRHR2 Q13324 2/20 0.41
MAOA P21397 2/20 0.41
MAOB P27338 2/20 0.41
HTT P42858 1/20 0.41
AHR P35869 1/20 0.34
OXTR P30559 1/20 0.34
GAA P10253 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
HSD17B3 P37058 1/20 0.33

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
SCHEMBL9787235 0.78 LMNA (0.61) ABCG2ITGB2ICAM1ITGALLMNA
SCHEMBL439199 0.77 ABCG2 (0.52) ABCG2ITGB2ICAM1ITGALLMNA
SCHEMBL6269163 0.73 LMNA (0.66) ABCG2ITGB2ICAM1ITGALLMNA
SCHEMBL13950599 0.73 THRB (0.35) LMNASMN1; SMN2NPC1RAB9AHTT
SCHEMBL1038843 0.71 ABCG2 (0.46) ABCG2ITGB2ICAM1ITGALLMNA
SCHEMBL442811 0.71 ABCG2 (0.46) ABCG2ITGB2ICAM1ITGALLMNA
SCHEMBL438269 0.71 ABCG2 (0.46) ABCG2ITGB2ICAM1ITGALLMNA
SCHEMBL279547 0.71 ABCG2 (0.46) ABCG2ITGB2ICAM1ITGALLMNA
SCHEMBL29966720 0.71 ABCG2 (0.46) ABCG2ITGB2ICAM1ITGALLMNA
SCHEMBL10195930 0.71 MAOA (0.65) ABCG2ITGB2ICAM1ITGALLMNA

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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1540329-A4 DRUG DISCOVERY METHOD KEDDEM BIO SCIENCE LTD (IL) 2009-06-10 EP claimed
JP-2006507480-A 2006-03-02 JP claimed
EP-1540329-A1 DRUG DISCOVERY METHOD KEDDEM BIO-SCIENCE LTD. (IL) 2005-06-15 EP claimed
WO-2004010136-A1 DRUG DISCOVERY METHOD KEDDEM BIO-SCIENCE LTD. (IL) 2004-01-29 WO claimed
US-11697695-B2 Polymerizable composition and optically anisotropic body using same DIC CORPORATION (JP) 2023-07-11 US disclosed
US-11697695-B2 Polymerizable composition and optically anisotropic body using same DIC CORPORATION (JP) 2023-07-11 US disclosed
US-11186669-B2 Polymerizable composition and optically anisotropic body using same DIC CORPORATION (JP) 2021-11-30 US disclosed
US-10927263-B2 Polymerizable composition and optically anisotropic body produced using the same DIC CORPORATION (JP) 2021-02-23 US disclosed
US-10723952-B2 Polymerizable compound and optically anisotropic body DIC CORPORATION (JP) 2020-07-28 US disclosed
US-20190264034-A1 POLYMERIZABLE COMPOSITION AND OPTICALLY ANISOTROPIC BODY PRODUCED USING THE SAME DIC CORPORATION (JP) 2019-08-29 US disclosed
US-20190233565-A1 POLYMERIZABLE COMPOSITION AND OPTICALLY ANISOTROPIC BODY USING SAME DIC CORPORATION (JP) 2019-08-01 US disclosed
US-10202470-B2 Polymerizable composition and optically anisotropic body using same DIC CORPORATION (JP) 2019-02-12 US disclosed
US-8019550-B2 Drug discovery method Keddem Bioscience Ltd. (IL) 2011-09-13 US disclosed
US-8019550-B2 Drug discovery method Keddem Bioscience Ltd. (IL) 2011-09-13 US disclosed
EP-1540329-A4 DRUG DISCOVERY METHOD KEDDEM BIO SCIENCE LTD (IL) 2009-06-10 EP disclosed
US-20050277117-A1 Drug discovery method KEDDEM BIO-SCIENCE LTD. (IL) 2005-12-15 US disclosed
EP-1540329-A1 DRUG DISCOVERY METHOD KEDDEM BIO-SCIENCE LTD. (IL) 2005-06-15 EP disclosed
WO-2004010136-A1 DRUG DISCOVERY METHOD KEDDEM BIO-SCIENCE LTD. (IL) 2004-01-29 WO disclosed
US-6492087-B1 PHOTOACID LABILE UNIT ATTACHED TO SUCH AS POLYHYDROXYSTYRENE THAT CAN GENERATE MULTIPLE ANIONS OR ACIDIC GROUPS SUCH AS HYDROXYL, PARTICULARLY PHENOLIC, COMPOUNDS VIA A DEPROTECTION REACTION WITHOUT RELEASING VOLATILE COMPONENTS SHIPLEY COMPANY, L.L.C. 2002-12-10 US disclosed
EP-1031878-A1 Novel polymers and photoresist compositions comprising same Shipley Company LLC (US) 2000-08-30 EP 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 (3 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-10927263-B2 Polymerizable composition and optically anisotropic body produced using the same CRYAA, IK, LCP1 ABCG2 3656/4885ITGB2 262/4885ICAM1 1193/4885
US-10723952-B2 Polymerizable compound and optically anisotropic body SMC4, SMCHD1, PHOSPHO1 ABCG2 2480/4885ITGB2 3328/4885ICAM1 3692/4885
US-20190264034-A1 POLYMERIZABLE COMPOSITION AND OPTICALLY ANISOTROPIC BODY PRODUCED USING THE SAME CRYAA, IK, LCP1 ABCG2 3656/4885ITGB2 262/4885ICAM1 1193/4885

“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.