SCHEMBL25055652

SCHEMBL25055652

CC(=O)N1CCCC2(C1)SCCN2C(C)=O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 8/20 0.37
HIF1A Q16665 2/20 0.37
CYP2D6 P10635 9/20 0.36
HSD17B10 Q99714 2/20 0.36
TSHR P16473 4/20 0.35
CYP1A2 P05177 3/20 0.35
ALDH1A1 P00352 3/20 0.34
ADRA2C P18825 1/20 0.33
USP2 O75604 2/20 0.32
CYP2C19 P33261 2/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2C9 P11712 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL25055607 0.90 ALDH1A1 (0.33) CYP3A4HIF1ACYP2D6HSD17B10TSHR
SCHEMBL26778507 0.87 CYP2D6 (0.34) CYP3A4HIF1ACYP2D6HSD17B10TSHR
SCHEMBL26778546 0.87 CYP3A4 (0.33) CYP3A4HIF1ACYP2D6HSD17B10TSHR
SCHEMBL25055528 0.87 L3MBTL1 (0.32) ADRA2C
SCHEMBL25055463 0.87
SCHEMBL25055618 0.84 SMN1; SMN2 (0.38) CYP1A2ADRA2CSMN1; SMN2
SCHEMBL25055720 0.84 CYP3A4 (0.37) CYP3A4HIF1ACYP2D6HSD17B10TSHR
SCHEMBL25055511 0.83 HPGD (0.37) ALDH1A1USP2MEN1KMT2ASMN1; SMN2
SCHEMBL25055566 0.83 DPP4 (0.33)
SCHEMBL25055689 0.83 DPP4 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348493-A1 COMPOUND FOR ADJUSTING ACTIVITY OF NMDA RECEPTOR, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF BEIJING GREATWAY PHARMACEUTICAL TECHNOLOGY CO. LTD. (CN) 2023-11-02 US disclosed
US-20230348493-A1 COMPOUND FOR ADJUSTING ACTIVITY OF NMDA RECEPTOR, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF BEIJING GREATWAY PHARMACEUTICAL TECHNOLOGY CO. LTD. (CN) 2023-11-02 US disclosed
EP-4137496-A1 COMPOUND FOR ADJUSTING ACTIVITY OF NMDA RECEPTOR, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF Beijing Greatway Pharmaceutical Technology Co., Ltd. (CN) 2023-02-22 EP 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 (1 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-20230348493-A1 COMPOUND FOR ADJUSTING ACTIVITY OF NMDA RECEPTOR, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF GRIN1, GRIN3A, GRIN2C CYP3A4 2169/4885HIF1A 1410/4885CYP2D6 1328/4885

“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.