SCHEMBL3073151

SCHEMBL3073151

c1ccc2c3c(ccc2c1)OCCO3

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 1/20 0.46
ICAM1 P05362 1/20 0.46
ITGAL P20701 1/20 0.46
HSD17B10 Q99714 3/20 0.44
ALDH1A1 P00352 2/20 0.44
CYP2A6 P11509 1/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 2/20 0.42
MAPT P10636 1/20 0.42
LMNA P02545 2/20 0.41
CRHBP P24387 2/20 0.41
CRHR2 Q13324 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
HPRT1 P00492 1/20 0.41
CYP1A2 P05177 1/20 0.41
GLA P06280 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL18929717 0.93 KDM4E (0.40) ITGB2ICAM1ITGALHSD17B10ALDH1A1
SCHEMBL30400843 0.83 BAD (0.49) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL403982 0.83 BAD (0.49) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL14159002 0.82 ITGB2 (0.41) ITGB2ICAM1ITGALHSD17B10ALDH1A1
SCHEMBL30240788 0.76 SMN1; SMN2 (0.54) ITGB2ICAM1ITGALHSD17B10ALDH1A1
SCHEMBL20346642 0.76 POLB (0.46) HSD17B10ALDH1A1TSHRTDP1KDM4E
SCHEMBL9871797 0.75 BAD (0.53) HSD17B10ALDH1A1CYP2A6TSHRTDP1
SCHEMBL12284409 0.73 GPR84 (0.49) ITGB2ICAM1ITGALHSD17B10ALDH1A1
SCHEMBL12283811 0.73 GPR84 (0.49) ITGB2ICAM1ITGALHSD17B10ALDH1A1
SCHEMBL30830197 0.73 KDM4E (0.56) ITGB2ICAM1ITGALHSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0651746-B1 DRUGS THAT ENHANCE SYNAPTIC RESPONSES MEDIATED BY AMPA RECEPTORS UNIV CALIFORNIA (US) 2002-03-27 EP claimed
JP-63094875-A None JP disclosed
CN-113614182-A Modified rhodamine dyes and their use in bioassays 生命技术公司 2021-11-05 CN disclosed
CN-113195639-A Asymmetric rhodamine dyes and their use in bioassays 生命技术公司 2021-07-30 CN disclosed
US-9915740-B1 High-symmetry organic scintillator systems NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2018-03-13 US disclosed
US-9885792-B1 High-symmetry organic scintillator systems NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2018-02-06 US disclosed
US-9753155-B1 High-symmetry organic scintillator systems NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2017-09-05 US disclosed
US-9709685-B1 High-symmetry organic scintillator systems NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2017-07-18 US disclosed
US-9678225-B1 High-symmetry organic scintillator systems NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2017-06-13 US disclosed
US-7789958-B2 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON (US) 2010-09-07 US disclosed
US-20070149673-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE STURGILL JEFFREY A 2007-06-28 US disclosed
US-20060106102-A1 Napththalene derivatives which inhibit the cytokine or biological activity of microphage migration inhibitory factor (mif) Morand, Eric 2006-05-18 US disclosed
EP-1549598-A1 NAPTHTHALENE DERIVATIVES WHICH INHIBIT THE CYTOKINE OR BIOLOGICAL ACTIVITY OF MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF) Cortical Pty Ltd (AU) 2005-07-06 EP disclosed
WO-2004065305-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE UNIVERSITY OF DAYTON (US) 2004-08-05 WO disclosed
US-20040104377-A1 Non-toxic corrosion-protection pigments based on rare earth elements UNIVERSITY OF DAYTON 2004-06-03 US disclosed
US-20040020568-A1 Non-toxic corrosion-protection conversion coats based on rare earth elements DAYTON, UNIVERSITY OF 2004-02-05 US disclosed
US-20040016910-A1 Non-toxic corrosion-protection rinses and seals based on rare earth elements DAYTON, UNIVERSITY OF 2004-01-29 US disclosed
US-20040011252-A1 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON 2004-01-22 US disclosed
WO-2003104178-A1 NAPTHTHALENE DERIVATIVES WHICH INHIBIT THE CYTOKINE OR BIOLOGICAL ACTIVITY OF MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF) CORTICAL PTY LTD (AU) 2003-12-18 WO disclosed
JP-S6394875-A RECORDING MATERIAL FUJI PHOTO FILM CO LTD 1988-04-25 JP 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 (1 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-20060106102-A1 Napththalene derivatives which inhibit the cytokine or biological activity of microphage migration inhibitory factor (mif) MIF, ARG1, MSR1 ITGB2 3704/4885ICAM1 154/4885ITGAL 3655/4885

“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.