SCHEMBL4670666

SCHEMBL4670666

O=C(O)[C@H]1CN(c2ccccc2)C(=O)O1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 14/20 0.54
FADS1 O60427 1/20 0.51
F10 P00742 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL2322579 1.00 GRM2 (0.54) GRM2FADS1F10SMN1; SMN2
SCHEMBL4669702 1.00 GRM2 (0.54) GRM2FADS1F10SMN1; SMN2
SCHEMBL5762328 0.88 GRM2 (0.53) GRM2FADS1F10
SCHEMBL12635405 0.87 GRM2 (0.51) GRM2FADS1F10
SCHEMBL4669143 0.84 L3MBTL1 (0.48) GRM2F10
SCHEMBL4669144 0.84 L3MBTL1 (0.48) GRM2F10
SCHEMBL4637383 0.84 FADS1 (0.60) GRM2FADS1
SCHEMBL4637380 0.84 FADS1 (0.60) GRM2FADS1
SCHEMBL7461978 0.82 MAOA (0.44) GRM2F10
SCHEMBL7460584 0.82 GRM2 (0.52) GRM2FADS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117777121-A Compounds and uses thereof 詹森药业有限公司 2024-03-29 CN disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
CN-110099898-B Compounds and uses thereof 优曼尼蒂治疗公司 2023-07-25 CN disclosed
US-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 US disclosed
WO-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 WO disclosed
EP-1937655-A1 HIV-1 PROTEASE INHIBITORS, AND METHODS OF MAKING AND USING THEM University of Massachusetts (US) 2008-07-02 EP disclosed
WO-2007002173-A1 HIV-1 PROTEASE INHIBITORS, AND METHODS OF MAKING AND USING THEM UNIVERSITY OF MASSACHUSETTS (US) 2007-01-04 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-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 GRM2 194/4885FADS1 1990/4885F10 2476/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 GRM2 194/4885FADS1 1990/4885F10 2476/4885

“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.