SCHEMBL22473277

SCHEMBL22473277

CC(C)(C)OC(=O)Nc1cc([C@H]2CCCCN2C(=O)OC(C)(C)C)ccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UCHL1 P09936 1/20 0.45
▸ TGFBR1 P36897 1/20 0.43
▸ PRMT5 O14744 5/20 0.42
▸ WDR77 Q9BQA1 5/20 0.42
▸ LMNA P02545 2/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ MAPK10 P53779 1/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ USP30 Q70CQ3 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ TSHR P16473 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ WNT3A P56704 1/20 0.39
▸ GAA P10253 1/20 0.39

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
SCHEMBL28675966 1.00 UCHL1 (0.45) UCHL1TGFBR1PRMT5WDR77LMNA
SCHEMBL20449176 0.92 TGFBR1 (0.43) UCHL1TGFBR1PRMT5WDR77LMNA
SCHEMBL20449177 0.92 TGFBR1 (0.43) UCHL1TGFBR1PRMT5WDR77LMNA
SCHEMBL28233547 0.83 TGFBR1 (0.44) UCHL1TGFBR1MAPK10NPC1GSK3B
SCHEMBL22473361 0.83 PRMT5 (0.43) UCHL1PRMT5WDR77LMNANPSR1
SCHEMBL29330323 0.80 NPC1 (0.53) PRMT5WDR77LMNANPSR1NPC1
SCHEMBL17151081 0.80 LMNA (0.46) UCHL1LMNANPSR1NPC1L3MBTL1
SCHEMBL3261075 0.79 PRMT5 (0.53) PRMT5WDR77LMNANPC1TSHR
SCHEMBL31305008 0.79 ALDH1A1 (0.42) UCHL1LMNANPSR1NPC1TSHR
SCHEMBL22726599 0.79 UCHL1 (0.52) UCHL1LMNANPSR1NPC1L3MBTL1

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-108290881-B Therapeutic compounds and methods of use thereof 健泰科生物技术公司 2021-12-07 — — CN disclosed
US-20210171516-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-06-10 — — US disclosed
US-20210171516-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-06-10 — — US disclosed
US-10787446-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2020-09-29 — — 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 (2 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-10787446-B2 Therapeutic compounds and methods of use thereof AVPR1B, C3AR1, RHEB UCHL1 4467/4885TGFBR1 2423/4885PRMT5 92/4885
US-20210171516-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF AVPR1B, C3AR1, RHEB UCHL1 4467/4885TGFBR1 2423/4885PRMT5 92/4885

“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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