SCHEMBL23918196

SCHEMBL23918196

Clc1cc(C2CC2)c(Br)cn1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 3/20 0.37
▸ CHRNA4 P43681 3/20 0.37
▸ CYP17A1 P05093 4/20 0.35
▸ IGF1R P08069 8/20 0.34
▸ NTRK1 P04629 1/20 0.32
▸ P2RX7 Q99572 1/20 0.32

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
SCHEMBL20772273 0.81 CYP17A1 (0.40) CHRNB2CHRNA4CYP17A1P2RX7
SCHEMBL26621158 0.76 SCN9A (0.37) CHRNB2CHRNA4CYP17A1IGF1R
SCHEMBL31026164 0.76 CYP17A1 (0.36) CHRNB2CHRNA4CYP17A1IGF1R
SCHEMBL29011987 0.76 CHRNB2 (0.36) CHRNB2CHRNA4IGF1R
SCHEMBL30945455 0.76 CYP17A1 (0.36) CHRNB2CHRNA4CYP17A1IGF1R
SCHEMBL17336541 0.76 NPC1 (0.34) CHRNB2CHRNA4
SCHEMBL30983136 0.75 CSNK2A1 (0.35) CHRNB2CHRNA4CYP17A1IGF1R
SCHEMBL23579469 0.75 CSNK2A1 (0.35) CHRNB2CHRNA4CYP17A1IGF1R
SCHEMBL15776554 0.75 CHRNB2 (0.41) CHRNB2CHRNA4CYP17A1
SCHEMBL15614997 0.75 CHRNB2 (0.41) CHRNB2CHRNA4CYP17A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240158415-A1 AMINOPYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL INC (US) 2024-05-16 — — US disclosed
CN-117642392-A Preparation and application of compounds with immunoregulation function 上海轶诺药业有限公司 2024-03-01 — — CN disclosed
US-11667651-B2 Aminopyridine derivatives as phosphatidylinositol phosphate kinase inhibitors HIBERCELL, INC. (US) 2023-06-06 — — US disclosed
US-11667651-B2 Aminopyridine derivatives as phosphatidylinositol phosphate kinase inhibitors HIBERCELL, INC. (US) 2023-06-06 — — US disclosed
US-11667651-B2 Aminopyridine derivatives as phosphatidylinositol phosphate kinase inhibitors HIBERCELL, INC. (US) 2023-06-06 — — US disclosed
WO-2022253327-A1 PREPARATION AND USE OF COMPOUND HAVING IMMUNOMODULATORY FUNCTION 上海轶诺药业有限公司 2022-12-08 — — WO disclosed
CN-115433210-A Preparation and application of compound with immunoregulation function 上海轶诺药业有限公司 2022-12-06 — — CN disclosed
US-20210317136-A1 AMINOPYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL, INC. 2021-10-14 — — US disclosed
US-20210317136-A1 AMINOPYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL, INC. 2021-10-14 — — US disclosed
CN-112020500-A Aminopyridine derivatives as inhibitors of phosphatidylinositol phosphokinase 拉文纳制药公司 2020-12-01 — — CN disclosed
EP-3728228-A1 AMINOPYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS Ravenna Pharmaceuticals, Inc. (US) 2020-10-28 — — EP disclosed
WO-2019043635-A1 D-AMINO ACID OXIDASE ACTIVITY INHIBITING COMPOUNDS RICHTER GEDEON NYRT. (HU) 2019-03-07 — — 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 (3 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-20240158415-A1 AMINOPYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS PIP5K1B, PIP5K1A, PIP5K1C CHRNB2 3375/4885CHRNA4 2086/4885CYP17A1 4474/4885
US-11667651-B2 Aminopyridine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1B, PIP5K1A, PIP5K1C CHRNB2 3228/4885CHRNA4 2017/4885CYP17A1 4528/4885
US-20210317136-A1 AMINOPYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS PIP5K1B, PIP5K1A, PIP5K1C CHRNB2 3228/4885CHRNA4 2017/4885CYP17A1 4528/4885

“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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