SCHEMBL22926078

SCHEMBL22926078

O=C(NOCc1ccccc1)c1ncc(Nc2nc(-c3ccc(C(F)(F)F)cc3)co2)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.46
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ PPIA P62937 1/20 0.38
▸ MGLL Q99685 1/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ HDAC7 Q8WUI4 1/20 0.38
▸ HDAC5 Q9UQL6 1/20 0.38
▸ LRRK2 Q5S007 2/20 0.36
▸ LTA4H P09960 1/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ TRPV1 Q8NER1 2/20 0.36
▸ S1PR1 P21453 1/20 0.36
▸ S1PR3 Q99500 1/20 0.36
▸ SMPD1 P17405 1/20 0.35
▸ F10 P00742 1/20 0.35
▸ MRGPRX4 Q96LA9 1/20 0.35
▸ ENPP3 O14638 1/20 0.35
▸ ENPP1 P22413 1/20 0.35
▸ MAPT P10636 1/20 0.35

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
SCHEMBL29621022 0.90 HSD11B1 (0.44) HSD11B1NPC1RAB9APPIAMGLL
SCHEMBL22925875 0.90 HSD11B1 (0.44) HSD11B1NPC1RAB9APPIAMGLL
SCHEMBL22925570 0.84 TRPV1 (0.46) NPC1RAB9APPIAMGLLTRPV1
SCHEMBL22925866 0.82 HSD11B1 (0.46) HSD11B1NPC1RAB9AMGLLHDAC4
SCHEMBL29621154 0.82 HSD11B1 (0.46) HSD11B1NPC1RAB9AMGLLHDAC4
SCHEMBL22925676 0.82 HSD11B1 (0.47) HSD11B1HDAC4HDAC7HDAC5TRPV1
SCHEMBL22926076 0.81 HSD11B1 (0.51) HSD11B1TRPV1MRGPRX4
SCHEMBL22926077 0.79 HSD11B1 (0.46) HSD11B1TRPV1MRGPRX4MAPT
SCHEMBL22925878 0.74 HSD11B1 (0.49) HSD11B1TRPV1
SCHEMBL29621000 0.73 VCP (0.44) NPC1RAB9APPIATRPV1

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
CN-114450281-B Inhibitor compounds 辛塞拉治疗私人有限公司 2024-08-16 — — CN disclosed
US-20220274970-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2022-09-01 — — US disclosed
EP-4003986-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2022-06-01 — — EP disclosed
CN-114450281-A Inhibitor compounds 辛塞拉治疗私人有限公司 2022-05-06 — — CN disclosed
WO-2021012018-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2021-01-28 — — 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-20220274970-A1 INHIBITOR COMPOUNDS SERPINB1, MMP1, SSB HSD11B1 843/4885NPC1 663/4885RAB9A 987/4885

“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.

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