SCHEMBL5771304

SCHEMBL5771304

O=C(CCc1cnoc1-c1ccc(F)cc1)NC1CCCCNC1=O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
APOL1 O14791 8/20 0.48
CCR2 P41597 3/20 0.45
MC4R P32245 1/20 0.41
RAB9A P51151 1/20 0.39
FPR1 P21462 2/20 0.39
FPR2 P25090 2/20 0.39
TACR2 P21452 1/20 0.39
TACR1 P25103 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL5777123 0.82 HPGD (0.50) RAB9AALDH1A1
SCHEMBL5774126 0.81 MEN1 (0.43) RAB9AALDH1A1
SCHEMBL5775136 0.76 BACE1 (0.47) RAB9A
SCHEMBL5774834 0.74 MAPT (0.45) ALDH1A1
SCHEMBL5776115 0.73 LMNA (0.56) RAB9AALDH1A1
SCHEMBL5769962 0.72 SMN1; SMN2 (0.41) RAB9AALDH1A1
SCHEMBL5773998 0.71 FFAR1 (0.46) ALDH1A1
SCHEMBL26583882 0.71 APOL1 (0.66) APOL1
SCHEMBL26583881 0.71 APOL1 (0.66) APOL1
SCHEMBL26584239 0.71 APOL1 (0.66) APOL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060084690-A1 Isoxazole derivatives MOMOSE YU 2006-04-20 US disclosed
US-7022725-B2 Isoxazole derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-04-04 US disclosed
US-20040048908-A1 Isoxazole derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-11 US disclosed
EP-1340749-A1 ISOXAZOLE DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2003-09-03 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 (2 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-20060084690-A1 Isoxazole derivatives INSR, GPR119, INSRR APOL1 1314/4885CCR2 3524/4885MC4R 396/4885
US-20040048908-A1 Isoxazole derivatives GPR119, INSR, IRS1 APOL1 1743/4885CCR2 3629/4885MC4R 405/4885

“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.