SCHEMBL20939136

SCHEMBL20939136

O[C@@]1(c2cc(Cl)cc3[nH]ncc23)C[C@H]2C[C@H]2C1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.40
IDO1 P14902 2/20 0.39
TDO2 P48775 1/20 0.39
NOS1 P29475 1/20 0.34
DYRK1A Q13627 1/20 0.34

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
SCHEMBL30073511 1.00 METAP2 (0.40) METAP2IDO1TDO2NOS1DYRK1A
SCHEMBL20939018 1.00 METAP2 (0.40) METAP2IDO1TDO2NOS1DYRK1A
SCHEMBL29092524 0.93 IDO1 (0.40) METAP2IDO1TDO2NOS1DYRK1A
SCHEMBL29092526 0.93 IDO1 (0.40) METAP2IDO1TDO2NOS1DYRK1A
SCHEMBL30073441 0.93 IDO1 (0.40) METAP2IDO1TDO2NOS1DYRK1A
SCHEMBL22584143 0.93 IDO1 (0.40) METAP2IDO1TDO2NOS1DYRK1A
SCHEMBL20939258 0.93 IDO1 (0.40) METAP2IDO1TDO2NOS1DYRK1A
SCHEMBL22584145 0.93 IDO1 (0.40) METAP2IDO1TDO2NOS1DYRK1A
SCHEMBL22584146 0.93 IDO1 (0.40) METAP2IDO1TDO2NOS1DYRK1A
SCHEMBL20939225 0.92 METAP2 (0.37) METAP2IDO1TDO2NOS1DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11548868-B2 Heterocyclic compounds, compositions comprising heterocyclic compound, and methods of use thereof JS INNOPHARM (SHANGHAI) LTD. (CN) 2023-01-10 US claimed
US-20200339533-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS COMPRISING HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS INNOPHARM (SHANGHAI) LTD (CN) 2020-10-29 US claimed
US-11548868-B2 Heterocyclic compounds, compositions comprising heterocyclic compound, and methods of use thereof JS INNOPHARM (SHANGHAI) LTD. (CN) 2023-01-10 US disclosed
US-11548868-B2 Heterocyclic compounds, compositions comprising heterocyclic compound, and methods of use thereof JS INNOPHARM (SHANGHAI) LTD. (CN) 2023-01-10 US disclosed
US-20200339533-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS COMPRISING HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS INNOPHARM (SHANGHAI) LTD (CN) 2020-10-29 US disclosed
US-20200339533-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS COMPRISING HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS INNOPHARM (SHANGHAI) LTD (CN) 2020-10-29 US disclosed
WO-2019076358-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS COMPRISING HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS INNOPHARM (SHANGHAI) LTD (CN) 2019-04-25 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-20200339533-A1 HETEROCYCLIC COMPOUNDS, COMPOSITIONS COMPRISING HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF IDO1, TDO2, IDO2 METAP2 735/4885IDO1 1/4885TDO2 2/4885
US-11548868-B2 Heterocyclic compounds, compositions comprising heterocyclic compound, and methods of use thereof IDO1, TDO2, IDO2 METAP2 735/4885IDO1 1/4885TDO2 2/4885

“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.