SCHEMBL22901928

SCHEMBL22901928

FC1(F)CC[C@H](Cc2ccc(Cl)cc2)NC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.36
POLB P06746 2/20 0.36
ALDH1A1 P00352 1/20 0.35
LTA4H P09960 2/20 0.34
KCNH2 Q12809 1/20 0.34
CHIA Q9BZP6 1/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
MAOA P21397 2/20 0.33
MAOB P27338 2/20 0.33
KDM1A O60341 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
SCHEMBL22903711 1.00 TRPA1 (0.36) TRPA1POLBALDH1A1LTA4HKCNH2
SCHEMBL22903757 0.85 MAOA (0.37) TRPA1ALDH1A1LTA4HKCNH2CHIA
SCHEMBL22901857 0.85 MAOA (0.37) TRPA1ALDH1A1LTA4HKCNH2CHIA
SCHEMBL21565752 0.77 POLB (0.47) POLBALDH1A1LTA4H
SCHEMBL18577408 0.76 CHIT1 (0.43) TRPA1ALDH1A1
SCHEMBL18577442 0.73 POLB (0.61) POLBLTA4H
SCHEMBL1443794 0.73 POLB (0.61) POLBLTA4H
SCHEMBL10132295 0.73 POLB (0.61) POLBLTA4H
SCHEMBL18577474 0.71 POLB (0.69) POLBLTA4H
SCHEMBL18577477 0.71 POLB (0.69) POLBLTA4H

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
US-11638707-B2 Substituted amino triazoles useful as chitinase inhibitors MOLECURE S.A. (PL) 2023-05-02 US disclosed
US-20210015822-A1 SUBSTITUTED AMINO TRIAZOLES USEFUL AS CHITINASE INHIBITORS GALAPAGOS NV (BE) 2021-01-21 US 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 (2 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-20210015822-A1 SUBSTITUTED AMINO TRIAZOLES USEFUL AS CHITINASE INHIBITORS CHIT1, CHIA, CHI3L1 TRPA1 959/4885POLB 2821/4885ALDH1A1 1494/4885
US-11638707-B2 Substituted amino triazoles useful as chitinase inhibitors CHIT1, CHIA, CHI3L1 TRPA1 959/4885POLB 2821/4885ALDH1A1 1494/4885

“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.