SCHEMBL3586967

SCHEMBL3586967

O=C(C1Cc2nc(-c3ccc(OCCCCl)cc3)sc2C1)N1CCC(F)(F)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 4/20 0.37
PPARA Q07869 4/20 0.37
HRH3 Q9Y5N1 4/20 0.36
GRM5 P41594 4/20 0.35
CYP2D6 P10635 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ENPP2 Q13822 3/20 0.34
ATXN2 Q99700 3/20 0.34
ACACB O00763 1/20 0.32

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
SCHEMBL3590124 0.90 PPARD (0.41) PPARDPPARAHRH3NPC1RAB9A
SCHEMBL3575279 0.87 HRH3 (0.46) PPARDPPARAHRH3NPC1RAB9A
SCHEMBL3585450 0.86 HRH3 (0.41) HRH3CYP2D6
SCHEMBL3586150 0.85 HRH3 (0.53) HRH3
SCHEMBL3581630 0.81 PPARD (0.45) PPARDPPARA
SCHEMBL3575828 0.80 PPARD (0.42) PPARDPPARANPC1RAB9AALDH1A1
SCHEMBL3582570 0.78 HRH2 (0.44) HRH3
SCHEMBL3575300 0.77 HRH3 (0.43) HRH3
SCHEMBL3574790 0.76 HRH3 (0.42) PPARDPPARAHRH3KDM4EMEN1
SCHEMBL3076700 0.76 HRH3 (0.55) PPARDPPARAHRH3NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100009969-A1 Fused Oxazoles & Thiazoles As Histamine H3- Receptor Ligands UCB PHARMA, S.A. (BE) 2010-01-14 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-20100009969-A1 Fused Oxazoles & Thiazoles As Histamine H3- Receptor Ligands HRH3, HRH4, HRH2 PPARD 1213/4885PPARA 1138/4885HRH3 1/4885

“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.