SCHEMBL22221911

SCHEMBL22221911

CCc1nc(CC(C)c2ncccc2Cl)ccc1C#N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 4/20 0.36
▸ GAA P10253 2/20 0.36
▸ HPGD P15428 6/20 0.35
▸ ALDH1A1 P00352 5/20 0.35
▸ CYP2D6 P10635 3/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ CYP1A2 P05177 2/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ TDP1 Q9NUW8 2/20 0.35
▸ S1PR1 P21453 3/20 0.34
▸ S1PR3 Q99500 3/20 0.34
▸ CYP3A4 P08684 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ TSHR P16473 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ TERT O14746 1/20 0.32

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
SCHEMBL20755826 0.72 HPGD (0.38) L3MBTL1GAAHPGDALDH1A1CYP2D6
SCHEMBL7215435 0.72 L3MBTL1 (0.39) L3MBTL1GAAHPGDALDH1A1TDP1
SCHEMBL23982943 0.69 CYP2D6 (0.39) L3MBTL1HPGDALDH1A1CYP2D6NPC1
SCHEMBL25070622 0.68 HPGD (0.43) L3MBTL1GAAHPGDALDH1A1CYP2D6
SCHEMBL22639290 0.68 KCNH2 (0.35) GAAALDH1A1CYP2D6NPC1RAB9A
SCHEMBL3791629 0.67 HPGD (0.51) L3MBTL1GAAHPGDALDH1A1CYP2D6
SCHEMBL23982947 0.66 CYP2D6 (0.38) GAACYP2D6NPC1CYP2C19RAB9A
SCHEMBL3809157 0.66 GLA (0.40) L3MBTL1GAAHPGDALDH1A1SMN1; SMN2
SCHEMBL3135265 0.65 KDM5A (0.35) L3MBTL1GAATDP1TSHRMAPK1
SCHEMBL10120091 0.65 HPGD (0.56) L3MBTL1GAAHPGDALDH1A1CYP2D6

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
US-11673885-B2 γ-diketones as Wnt/β-catenin signaling pathway activators BIOSPLICE THERAPEUTICS, INC. (US) 2023-06-13 — — US disclosed
US-20230053726-A1 GAMMA-DIKETONES AS WNT/BETA -CATENIN SIGNALING PATHWAY ACTIVATORS VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2023-02-23 — — US disclosed
US-11034682-B2 Gamma-diketones as wnt/β-catenin signaling pathway activators SAMUMED, LLC (US) 2021-06-15 — — US disclosed
US-20200223834-A1 GAMMA-DIKETONES AS WNT/BETA -CATENIN SIGNALING PATHWAY ACTIVATORS MED-PATHWAYS II LIMITED (VG) 2020-07-16 — — 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-20200223834-A1 GAMMA-DIKETONES AS WNT/BETA -CATENIN SIGNALING PATHWAY ACTIVATORS GSK3A, GSK3B, WNT1 L3MBTL1 3060/4885GAA 646/4885HPGD 1118/4885
US-20230053726-A1 GAMMA-DIKETONES AS WNT/BETA -CATENIN SIGNALING PATHWAY ACTIVATORS GSK3A, GSK3B, WNT1 L3MBTL1 3060/4885GAA 646/4885HPGD 1118/4885
US-11034682-B2 Gamma-diketones as wnt/β-catenin signaling pathway activators GSK3A, GSK3B, WNT1 L3MBTL1 3102/4885GAA 636/4885HPGD 1109/4885
US-11673885-B2 γ-diketones as Wnt/β-catenin signaling pathway activators GSK3A, GSK3B, WNT1 L3MBTL1 3173/4885GAA 793/4885HPGD 1166/4885

“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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