SCHEMBL23528871

SCHEMBL23528871

CCOC(=O)c1ccc(C2=NOC(c3cc(C(F)F)cc(C(F)F)c3)(C(F)(F)F)C2)cc1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.35
RAB9A P51151 4/20 0.35
ATM Q13315 2/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
SSTR5 P35346 2/20 0.33
PDK2 Q15119 3/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
F10 P00742 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PYGL P06737 1/20 0.31
GABRA1 P14867 2/20 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
SCHEMBL23528893 0.91 F2 (0.33) NPC1RAB9ACASP3SENP8SENP7
SCHEMBL23528923 0.88 RXRB (0.40) SSTR5HSD17B10CA1CA2
SCHEMBL736544 0.87 HSD17B10 (0.37) NPC1RAB9AATMCASP3SENP8
SCHEMBL28639154 0.87 NPC1 (0.37) NPC1RAB9AATMCASP3SENP8
SCHEMBL30309340 0.85 NPC1 (0.36) NPC1RAB9AATMCASP3SENP8
SCHEMBL16681006 0.83 HSD17B10 (0.36) NPC1RAB9AATMCASP3SENP8
SCHEMBL23536894 0.81 HDAC4 (0.30)
SCHEMBL23547904 0.81 HDAC4 (0.30)
SCHEMBL23536892 0.81 HDAC4 (0.30)
SCHEMBL29948767 0.81 HDAC4 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260070879-A1 ISOXAZOLINE DERIVATIVES ELANCO TIERGESUNDHEIT AG (CH) 2026-03-12 US disclosed
US-12497370-B2 Isoxazoline derivatives ELANCO TIERGESUNDHEIT AG (CH) 2025-12-16 US disclosed
CN-120004816-A Isoxazoline derivatives 礼蓝动物保健有限公司 2025-05-16 CN disclosed
CN-115210221-B Isoxazoline derivatives as pesticides 礼蓝动物保健有限公司 2025-03-18 CN disclosed
EP-4077286-A1 ISOXAZOLINE DERIVATIVES AS PESTICIDES Elanco Tiergesundheit AG (CH) 2022-10-26 EP disclosed
WO-2021127188-A1 ISOXAZOLINE DERIVATIVES AS PESTICIDES ELANCO TIERGESUNDHEIT AG (CH) 2021-06-24 WO disclosed
US-20210188789-A1 ISOXAZOLINE DERIVATIVES ELANCO TIERGESUNDHEIT AG 2021-06-24 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 (3 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-12497370-B2 Isoxazoline derivatives CYP3A7, CYP4X1, CYP2A7 NPC1 2587/4885RAB9A 1183/4885ATM 3221/4885
US-20260070879-A1 ISOXAZOLINE DERIVATIVES CHRM1, CBR3, AFF1 NPC1 1078/4885RAB9A 1217/4885ATM 3132/4885
US-20210188789-A1 ISOXAZOLINE DERIVATIVES CYP3A7, CYP4X1, SIRT7 NPC1 2405/4885RAB9A 850/4885ATM 3122/4885

“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.