SCHEMBL4205357

SCHEMBL4205357

O=C(O)c1cc2cc(OCc3ccccc3)ccc2n1Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.61
CCR2 P41597 5/20 0.60
SRD5A2 P31213 1/20 0.59
LTB4R Q15722 1/20 0.56
LTB4R2 Q9NPC1 1/20 0.56
PLA2G4A P47712 1/20 0.55
PPARD Q03181 2/20 0.53
PPARA Q07869 2/20 0.53
ABCB11 O95342 2/20 0.53
F10 P00742 3/20 0.52
CCR9 P51686 1/20 0.52
GPR35 Q9HC97 1/20 0.50
MRGPRX4 Q96LA9 1/20 0.50

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
SCHEMBL7241163 0.94 PPARG (0.59) PPARGCCR2SRD5A2LTB4RLTB4R2
SCHEMBL7247228 0.87 PPARG (0.57) PPARGCCR2SRD5A2LTB4RLTB4R2
SCHEMBL4198698 0.85 CCR2 (0.71) CCR2ABCB11CCR9
SCHEMBL4212911 0.85 CCR2 (0.64) CCR2ABCB11CCR9
SCHEMBL13802517 0.84 SRD5A2 (0.60) PPARGSRD5A2LTB4RLTB4R2PPARD
SCHEMBL7458022 0.83 CCR2 (0.52) PPARGCCR2SRD5A2LTB4RLTB4R2
SCHEMBL4208025 0.82 CCR2 (0.74) PPARGCCR2ABCB11CCR9GPR35
SCHEMBL3967516 0.80 CCR2 (0.73) PPARGCCR2SRD5A2LTB4RLTB4R2
SCHEMBL4201841 0.80 CCR2 (0.77) CCR2ABCB11CCR9
SCHEMBL700511 0.80 SRD5A2 (0.73) CCR2SRD5A2LTB4RLTB4R2PLA2G4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 US disclosed
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 US disclosed
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 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-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD APP, PSEN2, PSEN1 PPARG 1385/4885CCR2 1386/4885SRD5A2 2572/4885

“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.