SCHEMBL12420854

SCHEMBL12420854

O=C(O)c1ccnc(OCc2cccc(Cl)c2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 1/20 0.65
▸ RXRA P19793 2/20 0.63
▸ RXRB P28702 2/20 0.63
▸ RXRG P48443 2/20 0.63
▸ KDM5B Q9UGL1 2/20 0.63
▸ KDM5A P29375 1/20 0.63
▸ MRGPRX4 Q96LA9 10/20 0.56
▸ KDM4C Q9H3R0 2/20 0.52
▸ ALKBH1 Q13686 1/20 0.52
▸ MAOA P21397 2/20 0.51
▸ MAOB P27338 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ MITF O75030 1/20 0.51
▸ TP53 P04637 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ XBP1 P17861 1/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ NFKB2 Q00653 1/20 0.51

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
SCHEMBL837794 0.86 NR4A2 (0.58) NR4A2KDM5BKDM5AMRGPRX4KDM4C
SCHEMBL4679114 0.81 RXRA (0.67) NR4A2RXRARXRBRXRGKDM5B
SCHEMBL29784229 0.79 NR4A2 (1.00) NR4A2RXRARXRBRXRGMRGPRX4
SCHEMBL13802461 0.79 NR4A2 (1.00) NR4A2RXRARXRBRXRGMRGPRX4
SCHEMBL15779101 0.78 KDM5A (1.00) KDM5BKDM5AKDM4CKDM4A
SCHEMBL30822604 0.77 GLRA1 (0.51) NR4A2KDM5BKDM5AKDM4CALKBH1
SCHEMBL6522344 0.77 RXRA (1.00) NR4A2RXRARXRBRXRGMRGPRX4
SCHEMBL27189260 0.77 GLRA1 (0.51) NR4A2KDM5BKDM5AKDM4CALKBH1
SCHEMBL29784197 0.77 RXRA (1.00) NR4A2RXRARXRBRXRGMRGPRX4
SCHEMBL698500 0.77 MRGPRX4 (0.80) NR4A2RXRARXRBRXRGMRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110172230-A1 UREA COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-07-14 — — US disclosed
US-20110172230-A1 UREA COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-07-14 — — 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-20110172230-A1 UREA COMPOUND OR SALT THEREOF FAAH, FAAH2, UTS2R NR4A2 3133/4885RXRA 2656/4885RXRB 2309/4885

“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.

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