SCHEMBL29801436

SCHEMBL29801436

CCCCN(C(C)=O)c1ccc(-c2ccc(C(=O)NCc3cccnc3)cn2)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 1/20 0.53
▸ HPGDS O60760 2/20 0.51
▸ TSHR P16473 1/20 0.50
▸ NAMPT P43490 3/20 0.49
▸ LMNA P02545 4/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ ALDH1A1 P00352 4/20 0.48
▸ HTT P42858 2/20 0.48
▸ MAPT P10636 1/20 0.47
▸ GAA P10253 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ MMP13 P45452 1/20 0.44
▸ USP2 O75604 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ HPGD P15428 1/20 0.44

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
SCHEMBL24975115 1.00 TRPV1 (0.53) TRPV1HPGDSTSHRNAMPTLMNA
SCHEMBL29801077 0.88 HPGDS (0.49) TRPV1HPGDSTSHRNAMPTLMNA
SCHEMBL29801098 0.88 HPGDS (0.49) TRPV1HPGDSTSHRNAMPTLMNA
SCHEMBL24975159 0.88 HPGDS (0.49) TRPV1HPGDSTSHRNAMPTLMNA
SCHEMBL24975281 0.88 HPGDS (0.49) TRPV1HPGDSTSHRNAMPTLMNA
SCHEMBL29801120 0.88 HPGDS (0.49) TRPV1HPGDSTSHRNAMPTLMNA
SCHEMBL24975282 0.88 HPGDS (0.49) TRPV1HPGDSTSHRNAMPTLMNA
SCHEMBL29854321 0.87 GAA (0.48) HPGDSTSHRNAMPTLMNAMAPK1
SCHEMBL24975307 0.87 GAA (0.48) HPGDSTSHRNAMPTLMNAMAPK1
SCHEMBL24975353 0.86 LMNA (0.53) TRPV1HPGDSTSHRNAMPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119930509-A Cancer therapy targeting cancer stem cells 治疗方案股份有限公司 2025-05-06 — — CN disclosed
CN-114929672-B Cancer therapy targeting cancer stem cells 治疗方案股份有限公司 2025-01-21 — — CN disclosed
EP-4055008-A1 CANCER TREATMENTS TARGETING CANCER STEM CELLS Remedy Plan, Inc. (US) 2022-09-14 — — EP disclosed
CN-114929672-A Cancer therapy targeting cancer stem cells 治疗方案股份有限公司 2022-08-19 — — CN disclosed
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