SCHEMBL1689665

SCHEMBL1689665

CCOc1cccc(-c2cc(O)cc(-c3ccccc3)c2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.61
RXRB P28702 1/20 0.61
DHODH Q02127 1/20 0.49
ABL1 P00519 2/20 0.49
ABCB1 P08183 2/20 0.49
BCR P11274 2/20 0.49
FFAR1 O14842 1/20 0.48
MRGPRX4 Q96LA9 1/20 0.48
GGPS1 O95749 1/20 0.48
FYN P06241 1/20 0.47
SLC13A5 Q86YT5 1/20 0.47
CHRNB4 P30926 1/20 0.47
CHRNA3 P32297 1/20 0.47
KDM4E B2RXH2 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
FABP1 P07148 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL21944819 0.88 CHRNB4 (0.53) RXRARXRBCHRNB4CHRNA3KDM4E
SCHEMBL203120 0.88 RXRA (0.70) RXRARXRBDHODHFFAR1SLC13A5
SCHEMBL30338775 0.88 RXRA (0.70) RXRARXRBDHODHFFAR1SLC13A5
SCHEMBL28166768 0.82 RXRA (0.53) RXRARXRBKDM4EGAAMAPT
SCHEMBL29426410 0.82 RXRA (0.66) RXRARXRBFFAR1KDM4EGAA
SCHEMBL9260410 0.82 RXRA (0.66) RXRARXRBFFAR1KDM4EGAA
SCHEMBL29012837 0.80 RXRA (0.64) RXRARXRBFFAR1KDM4EGAA
SCHEMBL21359337 0.78 HSD17B1 (0.61) RXRARXRBCYP3A4
SCHEMBL19910984 0.77 CYP11B1 (0.63) RXRARXRBFFAR1CHRNB4CHRNA3
SCHEMBL4758879 0.76 RXRA (1.00) RXRARXRBDHODHFFAR1MRGPRX4

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8093385-B2 Leukotriene B4 inhibitors HOFFMANN-LA ROCHE INC. (US) 2012-01-10 US disclosed
US-8093385-B2 Leukotriene B4 inhibitors HOFFMANN-LA ROCHE INC. (US) 2012-01-10 US disclosed
US-8093385-B2 Leukotriene B4 inhibitors HOFFMANN-LA ROCHE INC. (US) 2012-01-10 US disclosed
WO-2009024492-A1 LEUKOTRIENE B4 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-02-26 WO disclosed
US-20090054466-A1 Leukotriene B4 Inhibitors DOMINIQUE ROMYR 2009-02-26 US disclosed
US-20090054466-A1 Leukotriene B4 Inhibitors DOMINIQUE ROMYR 2009-02-26 US disclosed
US-20090054466-A1 Leukotriene B4 Inhibitors DOMINIQUE ROMYR 2009-02-26 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 (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-20090054466-A1 Leukotriene B4 Inhibitors LTB4R2, LTB4R, LTC4S RXRA 986/4885RXRB 395/4885DHODH 568/4885

“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.