SCHEMBL5063186

SCHEMBL5063186

CCOC(=O)c1ccc(OCC(F)(F)F)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 1/20 0.48
JAK2 O60674 1/20 0.47
JAK3 P52333 1/20 0.47
PPARA Q07869 1/20 0.47
ALDH1A1 P00352 2/20 0.47
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 1/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
LMNA P02545 1/20 0.44
PAX8 Q06710 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.44
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44

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
SCHEMBL21434731 0.86 CYP1A2 (0.53) RAB9ASMN1; SMN2PPARAALDH1A1CYP1A2
SCHEMBL22833669 0.84 RAB9A (0.48) RAB9ASMN1; SMN2NPC1JAK2JAK3
SCHEMBL28012965 0.83 ALDH1A1 (0.49) RAB9ASMN1; SMN2NPC1PPARAALDH1A1
SCHEMBL2715087 0.83 ALDH1A1 (0.51) RAB9ASMN1; SMN2PPARAALDH1A1CYP1A2
SCHEMBL10469210 0.82 CA12 (0.57) RAB9ASMN1; SMN2NPC1JAK2JAK3
SCHEMBL5191370 0.82 KMT2A (0.50) RAB9ASMN1; SMN2NPC1PPARAALDH1A1
SCHEMBL5063439 0.81 KDM4E (0.50) RAB9ASMN1; SMN2PPARAALDH1A1CYP1A2
SCHEMBL2716480 0.81 KDM4E (0.50) SMN1; SMN2PPARAALDH1A1CYP1A2CYP2C9
SCHEMBL10468226 0.81 ALDH1A1 (0.60) RAB9ASMN1; SMN2NPC1JAK2JAK3
SCHEMBL6849228 0.80 MRGPRX4 (0.59) RAB9ASMN1; SMN2NPC1KDM4EMEN1

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-20080161294-A1 Urea derivative, medicinal composition containing the same, and medicinal use of these KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-07-03 US disclosed
EP-1867639-A1 UREA DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE OF THESE Kissei Pharmaceutical Co., Ltd. (JP) 2007-12-19 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-20080161294-A1 Urea derivative, medicinal composition containing the same, and medicinal use of these AVPR2, UTS2R, GPR119 RAB9A 1563/4885SMN1; SMN2 3056/4885NPC1 2311/4885

“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.