SCHEMBL25055720

SCHEMBL25055720

CC(=O)N1CCCC2(C1)SCCN2C

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 10/20 0.36
HSD17B10 Q99714 3/20 0.36
TSHR P16473 4/20 0.35
CYP1A2 P05177 4/20 0.35
ALDH1A1 P00352 3/20 0.34
TDP1 Q9NUW8 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
SCHEMBL25055609 0.90 CYP1A2 (0.35) CYP3A4HIF1ACYP2D6HSD17B10TSHR
SCHEMBL25055640 0.84 CYP1A2 (0.39) CYP1A2TDP1SMN1; SMN2
SCHEMBL25055652 0.84 CYP3A4 (0.37) CYP3A4HIF1ACYP2D6HSD17B10TSHR
SCHEMBL25055727 0.83 L3MBTL1 (0.33)
SCHEMBL25055730 0.83 ALDH1A1 (0.30) CYP2D6CYP1A2ALDH1A1CYP2C9
SCHEMBL25055621 0.80 CYP3A4 (0.35) CYP3A4HIF1ACYP2D6HSD17B10TSHR
SCHEMBL25055636 0.80 HPGD (0.39) ALDH1A1USP2MEN1KMT2ASMN1; SMN2
SCHEMBL25055637 0.80 DPP4 (0.33)
SCHEMBL25055650 0.80 DPP4 (0.33)
SCHEMBL25055728 0.80 CYP1A2 (0.42) CYP3A4HIF1ACYP2D6HSD17B10TSHR

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.