SCHEMBL13733945

SCHEMBL13733945

ON=C(Cl)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 4/20 0.43
MGLL Q99685 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
F10 P00742 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HSD11B1 P28845 1/20 0.40
GRIN2B Q13224 2/20 0.39
MAOB P27338 1/20 0.39
MPI P34949 1/20 0.39
GPR139 Q6DWJ6 1/20 0.38
DDR1 Q08345 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
CETP P11597 1/20 0.38

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
SCHEMBL13733944 1.00 KAT6A (0.43) KAT6AMGLLTAS1R3TAS1R1TAS1R2
SCHEMBL17134314 0.80 NPC1 (0.49) KAT6AMGLLTAS1R3TAS1R1TAS1R2
SCHEMBL7702314 0.80 NPC1 (0.49) KAT6AMGLLTAS1R3TAS1R1TAS1R2
SCHEMBL29478758 0.80 KAT6A (0.46) KAT6ATAS1R3TAS1R1TAS1R2F10
SCHEMBL1580873 0.80 KAT6A (0.46) KAT6ATAS1R3TAS1R1TAS1R2F10
SCHEMBL1580875 0.80 KAT6A (0.46) KAT6ATAS1R3TAS1R1TAS1R2F10
SCHEMBL29461392 0.79 KAT6A (0.51) KAT6AMGLLTAS1R3TAS1R1TAS1R2
SCHEMBL248669 0.79 KAT6A (0.51) KAT6AMGLLTAS1R3TAS1R1TAS1R2
SCHEMBL4040566 0.79 GRIN2B (0.44) GRIN2B
SCHEMBL4040563 0.79 GRIN2B (0.44) GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2699566-B1 PHENYL-ISOXAZOL DERIVATIVES AND PREPARATION PROCESS THEREOF IL-YANG PHARM CO LTD (KR) 2017-02-22 EP disclosed
US-9132126-B2 Phenyl-isoxazole derivatives and preparation process thereof IL-YANG PHARM. CO., LTD. (KR) 2015-09-15 US disclosed
EP-2699566-A1 PHENYL-ISOXAZOL DERIVATIVES AND PREPARATION PROCESS THEREOF Il-Yang Pharm. Co., Ltd. (KR) 2014-02-26 EP disclosed
US-20140031364-A1 PHENYL-ISOXAZOL DERIVATIVES AND PREPARATION PROCESS THEREOF IL-YANG PHARM. CO., LTD. (KR) 2014-01-30 US disclosed
WO-2012144752-A1 PHENYL-ISOXAZOL DERIVATIVES AND PREPARATION PROCESS THEREOF IL-YANG PHARM. CO., LTD. (KR) 2012-10-26 WO 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-20140031364-A1 PHENYL-ISOXAZOL DERIVATIVES AND PREPARATION PROCESS THEREOF PIR, ALPL, PIGS KAT6A 3101/4885MGLL 1570/4885TAS1R3 4384/4885

“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.