SCHEMBL29801070

SCHEMBL29801070

CC(=O)N(CC1COC1)c1ccc(-c2ccc(C(=O)NCc3cccnc3)cn2)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.43
▸ LMNA P02545 5/20 0.42
▸ RECQL P46063 1/20 0.42
▸ POLB P06746 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ HPGDS O60760 1/20 0.42
▸ ROCK2 O75116 1/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ TSHR P16473 3/20 0.42
▸ HTT P42858 2/20 0.42
▸ MAPT P10636 1/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ MMP13 P45452 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ GLA P06280 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL24975326 1.00 MAPK1 (0.43) MAPK1LMNARECQLPOLBNPC1
SCHEMBL24975147 0.93 NAMPT (0.46) MAPK1LMNARECQLPOLBNPC1
SCHEMBL29801000 0.93 NAMPT (0.46) MAPK1LMNARECQLPOLBNPC1
SCHEMBL29801082 0.92 NAMPT (0.43) MAPK1LMNAPOLBHPGDSROCK2
SCHEMBL24975162 0.92 NAMPT (0.43) MAPK1LMNAPOLBHPGDSROCK2
SCHEMBL24975197 0.89 LMNA (0.41) MAPK1LMNARECQLPOLBNPC1
SCHEMBL29801439 0.89 LMNA (0.41) MAPK1LMNARECQLPOLBNPC1
SCHEMBL24975132 0.88 HPGDS (0.48) MAPK1LMNAPOLBHPGDSROCK2
SCHEMBL29801485 0.88 HPGDS (0.48) MAPK1LMNAPOLBHPGDSROCK2
SCHEMBL24975154 0.88 MCHR1 (0.38) HPGDSROCK2CYP2C9

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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