SCHEMBL22903608

SCHEMBL22903608

CC(C)(C)OC(=O)N1CCC(N2C[C@H](CF)OC[C@@H]2Cc2ccc(Br)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 4/20 0.43
▸ KCNH2 Q12809 8/20 0.42
▸ TP53 P04637 1/20 0.40
▸ STS P08842 1/20 0.39
▸ CHIT1 Q13231 7/20 0.39
▸ CHIA Q9BZP6 7/20 0.39
▸ CHI3L1 P36222 5/20 0.39
▸ CHI3L2 Q15782 1/20 0.38
▸ PTPN2 P17706 1/20 0.37
▸ PTPN1 P18031 1/20 0.37
▸ PTPN6 P29350 1/20 0.37

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
SCHEMBL22903610 1.00 FPR2 (0.43) FPR2KCNH2TP53STSCHIT1
SCHEMBL26439568 0.88 KCNH2 (0.54) FPR2KCNH2TP53CHIT1CHIA
SCHEMBL26439359 0.86 CHIT1 (0.51) FPR2KCNH2TP53STSCHIT1
SCHEMBL22903589 0.83 NR1H2 (0.37) FPR2
SCHEMBL22903580 0.83 NR1H2 (0.37) FPR2
SCHEMBL18577482 0.83 CHIT1 (0.57) KCNH2STSCHIT1CHIACHI3L1
SCHEMBL18589408 0.83 CHIT1 (0.57) KCNH2STSCHIT1CHIACHI3L1
SCHEMBL18609869 0.83 CHIT1 (0.57) KCNH2STSCHIT1CHIACHI3L1
SCHEMBL18607914 0.83 CHIT1 (0.57) KCNH2STSCHIT1CHIACHI3L1
SCHEMBL18577086 0.81 CHIT1 (0.60) KCNH2STSCHIT1CHIACHI3L1

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 4 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
WO-2021009209-A1 SUBSTITUTED AMINO TRIAZOLES USEFUL AS CHITINASE INHIBITORS Oncoarendi Therapeutics S.A. (PL) 2021-01-21 — — 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-11638707-B2 Substituted amino triazoles useful as chitinase inhibitors CHIT1, CHIA, CHI3L1 FPR2 1416/4885KCNH2 3849/4885TP53 2719/4885

“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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