SCHEMBL1421764

SCHEMBL1421764

COc1ccc(-c2cc(=O)c3c(O)c(I)c(OC)cc3o2)cc1OC

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 5/20 0.76
CYP1A1 P04798 4/20 0.76
CYP1A2 P05177 2/20 0.76
OPRD1 P41143 1/20 0.76
HDAC6 Q9UBN7 2/20 0.71
MEN1 O00255 1/20 0.67
TP53 P04637 1/20 0.67
ABCB1 P08183 1/20 0.67
MDM2 Q00987 1/20 0.67
KMT2A Q03164 1/20 0.67
ABCG2 Q9UNQ0 1/20 0.67
FLT3 P36888 2/20 0.64
AURKA O14965 1/20 0.64
KDR P35968 1/20 0.64
AURKB Q96GD4 1/20 0.64
HSD17B2 P37059 1/20 0.61
TAS2R31 P59538 1/20 0.61
MAPT P10636 4/20 0.60
KDM4E B2RXH2 3/20 0.60
POLB P06746 3/20 0.60

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
SCHEMBL6243500 0.89 CYP1B1 (0.81) CYP1B1CYP1A1CYP1A2OPRD1HDAC6
SCHEMBL30445988 0.89 CYP1B1 (0.81) CYP1B1CYP1A1CYP1A2OPRD1HDAC6
SCHEMBL1976134 0.88 FLT3 (0.76) CYP1B1CYP1A1CYP1A2OPRD1MEN1
SCHEMBL1421602 0.88 ABCB1 (0.79) CYP1B1CYP1A1CYP1A2OPRD1HDAC6
SCHEMBL1976409 0.87 CYP1A1 (0.59) CYP1B1CYP1A1CYP1A2OPRD1HDAC6
SCHEMBL3131502 0.86 CYP1B1 (1.00) CYP1B1CYP1A1CYP1A2OPRD1HDAC6
SCHEMBL31238120 0.86 CYP1B1 (1.00) CYP1B1CYP1A1CYP1A2OPRD1HDAC6
SCHEMBL34468184 0.86 CYP1B1 (1.00) CYP1B1CYP1A1CYP1A2OPRD1HDAC6
SCHEMBL1980080 0.86 KDM4E (0.75) CYP1B1CYP1A1CYP1A2OPRD1HDAC6
SCHEMBL8062052 0.86 CYP1B1 (0.77) CYP1B1CYP1A1CYP1A2OPRD1HDAC6

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
US-20110144194-A1 CHROMENONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES AXOGLIA THERAPEUTICS (LU) 2011-06-16 US disclosed
EP-2297127-A1 CHROMENONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES AxoGlia Therapeutics S.A. (LU) 2011-03-23 EP disclosed
WO-2009130253-A1 CHROMENONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES AXOGLIA THERAPEUTICS S.A. (LU) 2009-10-29 WO disclosed
EP-2112145-A1 Chromenone derivatives useful for the treatment of neurodegenerative diseases AxoGlia Therapeutics S.A. (LU) 2009-10-28 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 (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-20110144194-A1 CHROMENONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES PARK7, CDR2, SNCA CYP1B1 684/4885CYP1A1 753/4885CYP1A2 524/4885

“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.