SCHEMBL29801077

SCHEMBL29801077

CC(=O)N(CCC(F)F)c1ccc(-c2ccc(C(=O)NCc3cccnc3)cn2)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 2/20 0.49
▸ LMNA P02545 5/20 0.48
▸ HTT P42858 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ NAMPT P43490 4/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ MAPT P10636 1/20 0.45
▸ GAA P10253 2/20 0.45
▸ POLB P06746 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ TSHR P16473 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MMP13 P45452 1/20 0.43
▸ TRPV1 Q8NER1 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
SCHEMBL24975159 1.00 HPGDS (0.49) HPGDSLMNAHTTALDH1A1NAMPT
SCHEMBL24975116 0.91 HPGDS (0.51) HPGDSLMNAHTTALDH1A1NAMPT
SCHEMBL29801230 0.91 HPGDS (0.51) HPGDSLMNAHTTALDH1A1NAMPT
SCHEMBL29801098 0.88 HPGDS (0.49) HPGDSLMNAHTTALDH1A1NAMPT
SCHEMBL24975282 0.88 HPGDS (0.49) HPGDSLMNAHTTALDH1A1NAMPT
SCHEMBL24975115 0.88 TRPV1 (0.53) HPGDSLMNAHTTALDH1A1NAMPT
SCHEMBL29801436 0.88 TRPV1 (0.53) HPGDSLMNAHTTALDH1A1NAMPT
SCHEMBL24975329 0.88 LMNA (0.43) HPGDSLMNAHTTALDH1A1MAPK1
SCHEMBL29801056 0.88 LMNA (0.43) HPGDSLMNAHTTALDH1A1MAPK1
SCHEMBL24975134 0.86 NAMPT (0.53) HPGDSLMNAHTTALDH1A1NAMPT

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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