SCHEMBL25643904

SCHEMBL25643904

N#CN=C(NCCCCCC1CCN(C(=O)c2ccco2)C1)Nc1cccnc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 8/20 0.41
▸ POLB P06746 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ PTPN2 P17706 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ CDK2 P24941 1/20 0.39
▸ FLT4 P35916 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ PKM P14618 1/20 0.38
▸ VNN1 O95497 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MAPT P10636 1/20 0.36

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
SCHEMBL25228313 1.00 NAMPT (0.41) NAMPTPOLBLMNACYP3A4CYP2C9
SCHEMBL25642288 1.00 NAMPT (0.41) NAMPTPOLBLMNACYP3A4CYP2C9
SCHEMBL25643928 1.00 NAMPT (0.41) NAMPTPOLBLMNACYP3A4CYP2C9
SCHEMBL25642269 1.00 NAMPT (0.41) NAMPTPOLBLMNACYP3A4CYP2C9
SCHEMBL19834806 0.95 NAMPT (0.46) NAMPTPOLBLMNACYP3A4CYP2C9
SCHEMBL25261833 0.92 PTPN2 (0.43) NAMPTPOLBCYP3A4CYP2C9PTPN2
SCHEMBL25642221 0.92 PTPN2 (0.43) NAMPTPOLBCYP3A4CYP2C9PTPN2
SCHEMBL25222285 0.92 PTPN2 (0.43) NAMPTPOLBCYP3A4CYP2C9PTPN2
SCHEMBL25642282 0.92 PTPN2 (0.43) NAMPTPOLBCYP3A4CYP2C9PTPN2
SCHEMBL27111087 0.91 NAMPT (0.37) NAMPTPOLBLMNACYP3A4CYP2C9

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-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-20230192615-A1 Pyridinylcyanoguanidine Derivative and Use Thereof Rushi Biotech (Hangzhou) Co., Ltd (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 (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-20240067607-A1 Pyridinylcyanoguanidine Derivative and Use Thereof NAMPT, NAPRT, NNMT NAMPT 1/4885POLB 2726/4885LMNA 2359/4885
US-11873284-B2 Pyridinylcyanoguanidine derivative and use thereof NAMPT, NAPRT, NNT NAMPT 1/4885POLB 2694/4885LMNA 2314/4885
US-20230192615-A1 Pyridinylcyanoguanidine Derivative and Use Thereof NAMPT, NAPRT, NNT NAMPT 1/4885POLB 2694/4885LMNA 2314/4885

“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.

Send feedback