SCHEMBL25273247

SCHEMBL25273247

NCCCCCC1CCN(C(=O)c2cccs2)C1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ MAPT P10636 2/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ HSD17B10 Q99714 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ GAA P10253 2/20 0.48
▸ ALDH1A1 P00352 3/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ PABPC1 P11940 1/20 0.45
▸ EIF4H Q15056 1/20 0.45
▸ THRB P10828 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HTT P42858 2/20 0.43
▸ POLB P06746 1/20 0.43

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
SCHEMBL25278094 1.00 SMN1; SMN2 (0.53) SMN1; SMN2MAPTNPC1RAB9AHSD17B10
SCHEMBL19834778 0.91 GAA (0.55) SMN1; SMN2MAPTNPC1RAB9AHSD17B10
SCHEMBL25235675 0.83 SMN1; SMN2 (0.48) SMN1; SMN2MAPTNPC1RAB9AHSD17B10
SCHEMBL25236879 0.80 HDAC3 (0.55) NPC1RAB9AL3MBTL1
SCHEMBL25273235 0.80 HDAC3 (0.55) NPC1RAB9AL3MBTL1
SCHEMBL25259072 0.80 HDAC3 (0.55) NPC1RAB9AL3MBTL1
SCHEMBL25218549 0.80 MEN1 (0.43) GAAALDH1A1KDM4ETHRB
SCHEMBL13738562 0.79 HDAC3 (0.56) NPC1RAB9AL3MBTL1
SCHEMBL25735183 0.78 PABPC1 (0.45) SMN1; SMN2MAPTNPC1RAB9AALDH1A1
SCHEMBL25735232 0.78 ALDH1A1 (0.48) SMN1; SMN2MAPTNPC1RAB9AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067607-A1 Pyridinylcyanoguanidine Derivative and Use Thereof WANG, ZHEMING (CN) 2024-02-29 — — US disclosed
US-20240067607-A1 Pyridinylcyanoguanidine Derivative and Use Thereof WANG, ZHEMING (CN) 2024-02-29 — — US disclosed
US-20240067607-A1 Pyridinylcyanoguanidine Derivative and Use Thereof WANG, ZHEMING (CN) 2024-02-29 — — US disclosed
US-11873284-B2 Pyridinylcyanoguanidine derivative and use thereof WANG, Zheming (CN) 2024-01-16 — — US disclosed
US-11873284-B2 Pyridinylcyanoguanidine derivative and use thereof WANG, Zheming (CN) 2024-01-16 — — US disclosed
US-11873284-B2 Pyridinylcyanoguanidine derivative and use thereof WANG, Zheming (CN) 2024-01-16 — — US disclosed
CN-116332818-B Tetrahydropyrrole derivatives and their use 王喆明 2023-12-15 — — CN disclosed
CN-116332818-A Tetrahydropyrrole derivatives and their use 王喆明 2023-06-27 — — CN disclosed
CN-116332917-A Pyridine cyanoguanidine derivative and application thereof 王喆明 2023-06-27 — — CN disclosed
US-20230192615-A1 Pyridinylcyanoguanidine Derivative and Use Thereof Rushi Biotech (Hangzhou) Co., Ltd (CN) 2023-06-22 — — US disclosed
US-20230192615-A1 Pyridinylcyanoguanidine Derivative and Use Thereof Rushi Biotech (Hangzhou) Co., Ltd (CN) 2023-06-22 — — US disclosed
US-20230192615-A1 Pyridinylcyanoguanidine Derivative and Use Thereof Rushi Biotech (Hangzhou) Co., Ltd (CN) 2023-06-22 — — US disclosed
US-20230192651-A1 Pyrrolidine Derivative and Use Thereof WANG, ZHEMING (CN) 2023-06-22 — — US disclosed
US-20230192651-A1 Pyrrolidine Derivative and Use Thereof WANG, ZHEMING (CN) 2023-06-22 — — US disclosed
US-20230192651-A1 Pyrrolidine Derivative and Use Thereof WANG, ZHEMING (CN) 2023-06-22 — — US 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 (4 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-20240067607-A1 Pyridinylcyanoguanidine Derivative and Use Thereof NAMPT, NAPRT, NNMT SMN1; SMN2 1828/4885MAPT 2999/4885NPC1 1860/4885
US-11873284-B2 Pyridinylcyanoguanidine derivative and use thereof NAMPT, NAPRT, NNT SMN1; SMN2 1771/4885MAPT 3091/4885NPC1 2003/4885
US-20230192651-A1 Pyrrolidine Derivative and Use Thereof NAMPT, NAPRT, NNMT SMN1; SMN2 1560/4885MAPT 1410/4885NPC1 1650/4885
US-20230192615-A1 Pyridinylcyanoguanidine Derivative and Use Thereof NAMPT, NAPRT, NNT SMN1; SMN2 1771/4885MAPT 3091/4885NPC1 2003/4885

“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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