Sugi Predict

Sugi Predict / Compounds / SCHEMBL2520969

SCHEMBL2520969

SCHEMBL2520969

O=C(NCc1cc(C2=NOC(c3cc(Cl)c(F)c(Cl)c3)(C(F)(F)F)C2)ccc1F)C1CC(F)(F)C1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 6/20 0.34
▸ POLB P06746 3/20 0.33
▸ LMNA P02545 3/20 0.33
▸ GAA P10253 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ KMT2A Q03164 2/20 0.31
▸ MTOR P42345 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ RORC P51449 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ FPR3 P25089 1/20 0.31
▸ FPR2 P25090 1/20 0.31
▸ EPHX2 P34913 1/20 0.31
▸ P2RX7 Q99572 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ PLA2G1B P04054 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ CNR1 P21554 1/20 0.30

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
SCHEMBL2522173 0.93 MTOR (0.37) POLBLMNAGAANPSR1KMT2A
SCHEMBL2524299 0.87 MTOR (0.37) POLBLMNAGAANPSR1KMT2A
SCHEMBL2523120 0.86 MTOR (0.34) TRPA1POLBMTORCNR1
SCHEMBL2521783 0.86 MTOR (0.38) POLBLMNAGAANPSR1KMT2A
SCHEMBL2521753 0.84 RAB9A (0.36) TRPA1POLBLMNAALDH1A1P2RX7
SCHEMBL2521265 0.83 PDE3B (0.35) KMT2AALDH1A1HTTMEN1HPGD
SCHEMBL14685964 0.82 FFAR1 (0.33) LMNAALDH1A1P2RX7CNR1
SCHEMBL2518676 0.81 LMNA (0.37) LMNAMTOR
SCHEMBL2524696 0.81 MTOR (0.34) TRPA1POLBMTOREPHX2CNR1
SCHEMBL15803905 0.80 EPHX2 (0.38) TRPA1POLBLMNAGAANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2556060-A1 SUBSTITUTED 3,5- DIPHENYL-ISOXAZOLINE DERIVATIVES AS INSECTICIDES AND ACARICIDES AH USA 42 LLC (US) 2013-02-13 — — EP claimed
WO-2011124998-A1 SUBSTITUTED 3,5- DI PHENYL - ISOXAZOLINE DERIVATIVES AS INSECTICIDES AND ACARICIDES PFIZER INC. (US) 2011-10-13 — — WO claimed
US-20110251247-A1 SUBSTITUTED ISOXAZOLINE DERIVATIVES PFIZER INC. (US) 2011-10-13 — — US claimed
EP-2556060-A1 SUBSTITUTED 3,5- DIPHENYL-ISOXAZOLINE DERIVATIVES AS INSECTICIDES AND ACARICIDES AH USA 42 LLC (US) 2013-02-13 — — EP disclosed
WO-2011124998-A1 SUBSTITUTED 3,5- DI PHENYL - ISOXAZOLINE DERIVATIVES AS INSECTICIDES AND ACARICIDES PFIZER INC. (US) 2011-10-13 — — WO disclosed
WO-2011124998-A1 SUBSTITUTED 3,5- DI PHENYL - ISOXAZOLINE DERIVATIVES AS INSECTICIDES AND ACARICIDES PFIZER INC. (US) 2011-10-13 — — WO disclosed
US-20110251247-A1 SUBSTITUTED ISOXAZOLINE DERIVATIVES PFIZER INC. (US) 2011-10-13 — — US disclosed
US-20110251247-A1 SUBSTITUTED ISOXAZOLINE DERIVATIVES PFIZER INC. (US) 2011-10-13 — — US disclosed
US-20110251247-A1 SUBSTITUTED ISOXAZOLINE DERIVATIVES PFIZER INC. (US) 2011-10-13 — — 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-20110251247-A1 SUBSTITUTED ISOXAZOLINE DERIVATIVES CYP4X1, COL1A1, RDX TRPA1 3481/4885POLB 1501/4885LMNA 1172/4885

“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.