SCHEMBL26439349

SCHEMBL26439349

CC(C)(C)OC(=O)N1C[C@H](C(C)(C)O)OC[C@@H]1Cc1ccc(Br)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 4/20 0.39
▸ NR1H3 Q13133 3/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CHIT1 Q13231 2/20 0.38
▸ CHIA Q9BZP6 2/20 0.38
▸ CHI3L1 P36222 1/20 0.38
▸ FPR3 P25089 1/20 0.36
▸ FPR2 P25090 1/20 0.36
▸ RORC P51449 2/20 0.36
▸ USP30 Q70CQ3 2/20 0.35
▸ KCNK3 O14649 1/20 0.34
▸ KCNK9 Q9NPC2 1/20 0.34
▸ MAPK8 P45983 1/20 0.34
▸ DPP4 P27487 1/20 0.33
▸ KLK7 P49862 1/20 0.33
▸ MCL1 Q07820 1/20 0.33
▸ GPR119 Q8TDV5 2/20 0.33
▸ HDAC1 Q13547 1/20 0.33

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
SCHEMBL18607977 0.89 CHIT1 (0.48) NR1H2NR1H3KMT2ACHIT1CHIA
SCHEMBL18607759 0.89 CHIT1 (0.48) NR1H2NR1H3KMT2ACHIT1CHIA
SCHEMBL20747186 0.89 CHIT1 (0.48) NR1H2NR1H3KMT2ACHIT1CHIA
SCHEMBL18589339 0.89 CHIT1 (0.48) NR1H2NR1H3KMT2ACHIT1CHIA
SCHEMBL22903811 0.85 NR1H2 (0.38) NR1H2NR1H3KMT2AFPR3FPR2
SCHEMBL22903606 0.85 NR1H2 (0.38) NR1H2NR1H3KMT2AFPR3FPR2
SCHEMBL26439338 0.85 KMT2A (0.41) NR1H2NR1H3KMT2AFPR3FPR2
SCHEMBL22903589 0.84 NR1H2 (0.37) NR1H2NR1H3KMT2AFPR3FPR2
SCHEMBL30612496 0.84 NR1H2 (0.37) NR1H2NR1H3KMT2AFPR3FPR2
SCHEMBL22903580 0.84 NR1H2 (0.37) NR1H2NR1H3KMT2AFPR3FPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11638707-B2 Substituted amino triazoles useful as chitinase inhibitors MOLECURE S.A. (PL) 2023-05-02 — — US disclosed
EP-3999500-A1 SUBSTITUTED AMINO TRIAZOLES USEFUL AS CHITINASE INHIBITORS OncoArendi Therapeutics S.A. (PL) 2022-05-25 — — EP disclosed
CN-114174280-A Substituted aminotriazoles useful as chitinase inhibitors 昂科艾伦迪治疗法公司 2022-03-11 — — CN 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-11638707-B2 Substituted amino triazoles useful as chitinase inhibitors CHIT1, CHIA, CHI3L1 NR1H2 812/4885NR1H3 708/4885KMT2A 2195/4885

“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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