SCHEMBL18608053

SCHEMBL18608053

CC(C)(C)OC(=O)N1CC[C@@H]1Cc1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
ALDH1A1 P00352 2/20 0.45
STS P08842 2/20 0.45
NR1H2 P55055 2/20 0.44
NR1H3 Q13133 2/20 0.44
NPSR1 Q6W5P4 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 1/20 0.44
OPRK1 P41145 2/20 0.43
HPGD P15428 2/20 0.43
VEGFA P15692 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
USP2 O75604 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALOX5AP P20292 2/20 0.42
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
GRM5 P41594 1/20 0.41
NR1D1 P20393 1/20 0.41

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
SCHEMBL18609579 1.00 MEN1 (0.45) MEN1KMT2AALDH1A1STSNR1H2
SCHEMBL10132293 0.92 ALDH1A1 (0.51) MEN1KMT2AALDH1A1STSNR1H2
SCHEMBL22036268 0.91 HPGD (0.49) MEN1KMT2AALDH1A1STSNR1H2
SCHEMBL18609734 0.89 ALDH1A1 (0.41) MEN1KMT2AALDH1A1STSNR1H2
SCHEMBL20628853 0.89 ALDH1A1 (0.41) MEN1KMT2AALDH1A1STSNR1H2
SCHEMBL18589367 0.89 ALDH1A1 (0.41) MEN1KMT2AALDH1A1STSNR1H2
SCHEMBL18607980 0.89 ALDH1A1 (0.41) MEN1KMT2AALDH1A1STSNR1H2
SCHEMBL18608049 0.89 ALDH1A1 (0.41) MEN1KMT2AALDH1A1STSNR1H2
SCHEMBL18589350 0.89 ALDH1A1 (0.41) MEN1KMT2AALDH1A1STSNR1H2
SCHEMBL28334409 0.88 ALDH1A1 (0.40) MEN1KMT2AALDH1A1STSNR1H2

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
US-10208020-B2 Substituted amino triazoles useful as human chitinase inhibitors Oncoarendi Therapeutics S.A. (PL) 2019-02-19 US disclosed
EP-3344616-B1 SUBSTITUTED AMINO TRIAZOLES USEFUL AS HUMAN CHITINASE INHIBITORS ONCOARENDI THERAPEUTICS SA (PL) 2019-01-09 EP disclosed
US-9944624-B2 Substituted amino triazoles useful as human chitinase inhibitors Oncoarendi Therapeutics S.A. (PL) 2018-04-17 US disclosed
US-20170066743-A1 SUBSTITUTED AMINO TRIAZOLES USEFUL AS HUMAN CHITINASE INHIBITORS GALAPAGOS NV (BE) 2017-03-09 US disclosed
WO-2017037670-A1 SUBSTITUTED AMINO TRIAZOLES USEFUL AS HUMAN CHITINASE INHIBITORS OncoArendi Therapeutics Sp. z o.o. (PL) 2017-03-09 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-10208020-B2 Substituted amino triazoles useful as human chitinase inhibitors CHIA, CHIT1, AADAC MEN1 1726/4885KMT2A 1534/4885ALDH1A1 1830/4885
US-20170066743-A1 SUBSTITUTED AMINO TRIAZOLES USEFUL AS HUMAN CHITINASE INHIBITORS CHIA, CHIT1, AADAC MEN1 1726/4885KMT2A 1534/4885ALDH1A1 1830/4885

“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.