SCHEMBL983569

SCHEMBL983569

O=C(O)CSCC(=O)NCc1ccc(C2=NOC(c3cc(Cl)c(Cl)c(Cl)c3)(C(F)(F)F)C2)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.43
HSD11B1 P28845 1/20 0.36
GAA P10253 1/20 0.36
FABP4 P15090 3/20 0.33
FABP3 P05413 2/20 0.33
MAPT P10636 3/20 0.32
POLB P06746 2/20 0.32
TP53 P04637 2/20 0.32
EPHX2 P34913 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
LMNA P02545 1/20 0.31
P2RX7 Q99572 1/20 0.31
RECQL P46063 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
SCHEMBL980947 0.92 ALDH1A1 (0.38) ALDH1A1L3MBTL1HSD11B1MAPTPOLB
SCHEMBL983573 0.90 ALDH1A1 (0.35) ALDH1A1HSD11B1TP53EPHX2NR1H4
SCHEMBL981199 0.90 ALDH1A1 (0.36) ALDH1A1L3MBTL1HSD11B1MAPTPOLB
SCHEMBL983571 0.88 ALDH1A1 (0.34) ALDH1A1HSD11B1MAPTPOLBTP53
SCHEMBL980955 0.87 HSD11B1 (0.35) HSD11B1TP53EPHX2NR1H4LMNA
SCHEMBL979491 0.87 HSD11B1 (0.35) HSD11B1TP53EPHX2NR1H4LMNA
SCHEMBL3620024 0.87 TP53 (0.35) ALDH1A1HSD11B1MAPTTP53EPHX2
SCHEMBL12948804 0.83 ALDH1A1 (0.37) ALDH1A1HSD11B1MAPTPOLBTP53
SCHEMBL2523771 0.82 CNR1 (0.34) ALDH1A1HSD11B1TP53LMNAP2RX7
SCHEMBL2189026 0.81 CA1 (0.35) ALDH1A1HSD11B1MAPTTP53EPHX2

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-8318757-B2 Substituted isoxazoline compound and pest control agent NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-11-27 US disclosed
US-20110009438-A1 SUBSTITUTED ISOXAZOLINE COMPOUND AND PEST CONTROL AGENT NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-01-13 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-20110009438-A1 SUBSTITUTED ISOXAZOLINE COMPOUND AND PEST CONTROL AGENT CCR10, H1-10, CCL11 ALDH1A1 3126/4885L3MBTL1 103/4885HSD11B1 1009/4885

“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.