SCHEMBL3366496

SCHEMBL3366496

O=C(OCc1ccccc1)c1cc2ccccc2oc1=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.71
MIF P14174 1/20 0.68
KDM4E B2RXH2 7/20 0.67
ALDH1A1 P00352 6/20 0.67
TSHR P16473 2/20 0.65
HSD17B10 Q99714 1/20 0.65
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
NPSR1 Q6W5P4 1/20 0.64
HPGD P15428 1/20 0.63
MAOB P27338 5/20 0.63
MAPT P10636 1/20 0.62
CA12 O43570 2/20 0.61
CA9 Q16790 2/20 0.61
CA1 P00915 1/20 0.61
CA3 P07451 1/20 0.61
CA4 P22748 1/20 0.61
CA6 P23280 1/20 0.61
CA5A P35218 1/20 0.61
CA7 P43166 1/20 0.61

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
SCHEMBL28295864 0.88 MIF (0.72) POLBMIFKDM4EALDH1A1MEN1
SCHEMBL27952014 0.86 MEN1 (0.62) POLBMIFALDH1A1MEN1KMT2A
SCHEMBL20582728 0.85 POLB (0.80) POLBMIFKDM4EALDH1A1TSHR
SCHEMBL93300 0.85 MAOB (0.85) MAOBCA12CA1CA4CA5A
SCHEMBL2910106 0.83 SLC16A3 (0.64) POLBMIFKDM4EALDH1A1TSHR
SCHEMBL6243624 0.83 KDM4E (0.80) POLBMIFKDM4EALDH1A1TSHR
SCHEMBL21187892 0.82 MAPT (0.68) POLBKDM4EALDH1A1TSHRHSD17B10
SCHEMBL27951953 0.82 POLB (0.75) POLBKDM4EALDH1A1MEN1KMT2A
SCHEMBL31545303 0.81 MIF (0.62) POLBMIFKDM4EALDH1A1TSHR
SCHEMBL14134646 0.81 MIF (0.72) POLBMIFKDM4EALDH1A1TSHR

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
EP-3913375-A1 MICROFLUIDIC DEVICES AND METHODS OF USE IN THE FORMATION AND CONTROL OF NANOREACTORS Bio-Rad Laboratories, Inc. (US) 2021-11-24 EP disclosed
US-20100009970-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES COMBINATORX (SINGAPORE) PTE. LTD. (SG) 2010-01-14 US disclosed
US-20080161324-A1 Compositions and methods for treatment of viral diseases EXCRX (SINGAPORE) PTE. LTD. (F.K.A. COMBINATORX (SINGAPORE) PTE LTD.) (SG) 2008-07-03 US disclosed
WO-2008033466-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES COMBINATORX (SINGAPORE) PRE. LTD. (SG) 2008-03-20 WO 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-20100009970-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES HTR1A, HTR3B, HTR3A POLB 469/4885MIF 4650/4885KDM4E 192/4885
US-20080161324-A1 Compositions and methods for treatment of viral diseases HAVCR2, EIF2AK2, RNASE1 POLB 249/4885MIF 3913/4885KDM4E 861/4885

“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.