SCHEMBL20032385

SCHEMBL20032385

CCC(CC)c1ccc(Cl)s1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.49
GABBR1 Q9UBS5 1/20 0.49
WRN Q14191 1/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
KCNH2 Q12809 1/20 0.34
CXCR1 P25024 1/20 0.34
CXCR2 P25025 1/20 0.34
TP53 P04637 2/20 0.33
MAPT P10636 2/20 0.33
GSK3B P49841 1/20 0.32
TSHR P16473 2/20 0.32
F2 P00734 1/20 0.31
DAO P14920 1/20 0.31
SMN1; SMN2 Q16637 3/20 0.31
HTT P42858 2/20 0.31
KMT2A Q03164 2/20 0.31

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
SCHEMBL5254188 0.85 GABBR2 (0.41) GABBR2GABBR1WRNCYP3A4CYP2D6
SCHEMBL22795551 0.83 GABBR2 (0.46) GABBR2GABBR1WRNCYP3A4CYP2D6
SCHEMBL14295828 0.80 GABBR2 (0.40) GABBR2GABBR1WRNCYP3A4CYP2D6
SCHEMBL14450765 0.78 GABBR2 (0.42) GABBR2GABBR1WRNCYP3A4CYP2D6
SCHEMBL22585593 0.78 GABBR2 (0.42) GABBR2GABBR1WRNCYP3A4CYP2D6
SCHEMBL23258012 0.78 GABBR2 (0.42) GABBR2GABBR1WRNCYP3A4CYP2D6
SCHEMBL15157293 0.78 GABBR2 (0.42) GABBR2GABBR1WRNCYP3A4CYP2D6
SCHEMBL12261844 0.78 GABBR2 (0.42) GABBR2GABBR1WRNCYP3A4CYP2D6
SCHEMBL19386720 0.77 GABBR2 (0.38) GABBR2GABBR1WRNCYP3A4CYP2D6
SCHEMBL21779330 0.77 MEN1 (0.42) GABBR2GABBR1SLC6A4SLC6A3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11759462-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors ALTAVANT SCIENCES GMBH 2023-09-19 US disclosed
US-11330821-B2 Herbicidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2022-05-17 US disclosed
US-20210205305-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2021-07-08 US disclosed
US-10946018-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors ROIVANT SCIENCES GMBH (CH) 2021-03-16 US disclosed
WO-2020249799-A1 PYRIDINE CARBAMATES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-12-17 WO disclosed
US-20200237760-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ROIVANT SCIENCES GMBH (CH) 2020-07-30 US disclosed
US-10660893-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors ROIVANT SCIENCES, GmbH (CH) 2020-05-26 US disclosed
US-20190282575-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2019-09-19 US disclosed
US-10350208-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors ROIVANT SCIENCES GMBH (CH) 2019-07-16 US disclosed
US-20180116219-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-05-03 US disclosed
US-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS ALTAVANT SCIENCES GMBH (CH) 2018-04-05 US 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 (10 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-10660893-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A GABBR2 3675/4885GABBR1 3158/4885WRN 1331/4885
US-20200237760-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A GABBR2 3675/4885GABBR1 3158/4885WRN 1331/4885
US-20180092918-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A GABBR2 3675/4885GABBR1 3158/4885WRN 1331/4885
US-20210205305-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A GABBR2 3675/4885GABBR1 3158/4885WRN 1331/4885
US-10350208-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A GABBR2 3675/4885GABBR1 3158/4885WRN 1331/4885
US-11330821-B2 Herbicidal compounds DDT, HPD, HDHD5 GABBR2 770/4885GABBR1 644/4885WRN 1157/4885
US-11759462-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A GABBR2 3675/4885GABBR1 3158/4885WRN 1331/4885
US-20190282575-A1 SPIROCYCLIC COMPOUNDS AS TRYPTOPHAN HYDROXYLASE INHIBITORS TPH1, TPH2, HTR1A GABBR2 3675/4885GABBR1 3158/4885WRN 1331/4885
US-20180116219-A1 HERBICIDAL COMPOUNDS DDT, HPD, HDHD5 GABBR2 770/4885GABBR1 644/4885WRN 1157/4885
US-10946018-B2 Spirocyclic compounds as tryptophan hydroxylase inhibitors TPH1, TPH2, HTR1A GABBR2 3675/4885GABBR1 3158/4885WRN 1331/4885

“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.