SCHEMBL20449176

SCHEMBL20449176

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

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 1/20 0.43
▸ PRMT5 O14744 6/20 0.42
▸ WDR77 Q9BQA1 6/20 0.42
▸ MAPK10 P53779 1/20 0.41
▸ CPT1A P50416 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ UCHL1 P09936 1/20 0.39
▸ DYRK1A Q13627 2/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ RIPK1 Q13546 1/20 0.39
▸ NR3C2 P08235 1/20 0.38
▸ PIK3C3 Q8NEB9 2/20 0.38
▸ ATR Q13535 1/20 0.38
▸ CDK5 Q00535 1/20 0.38
▸ CDK5R1 Q15078 1/20 0.38
▸ NAMPT P43490 1/20 0.37

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
SCHEMBL20449177 1.00 TGFBR1 (0.43) TGFBR1PRMT5WDR77MAPK10CPT1A
SCHEMBL22473277 0.92 UCHL1 (0.45) TGFBR1PRMT5WDR77MAPK10LMNA
SCHEMBL28675966 0.92 UCHL1 (0.45) TGFBR1PRMT5WDR77MAPK10LMNA
SCHEMBL28233547 0.83 TGFBR1 (0.44) TGFBR1MAPK10CPT1AUCHL1DYRK1A
SCHEMBL28233608 0.76 NR3C2 (0.39) TGFBR1DYRK1AGSK3BNR3C2PIK3C3
SCHEMBL28233607 0.76 NR3C2 (0.39) TGFBR1DYRK1AGSK3BNR3C2PIK3C3
SCHEMBL22473361 0.74 PRMT5 (0.43) PRMT5WDR77LMNAUCHL1RIPK1
SCHEMBL3312570 0.73 MAPT (0.49) —
SCHEMBL18394381 0.73 PROKR1 (0.45) PRMT5WDR77RIPK1
SCHEMBL24366433 0.72 PRMT5 (0.57) PRMT5WDR77

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-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
US-20180291014-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-10-11 — — US disclosed
EP-3356360-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF Genentech, Inc. (US) 2018-08-08 — — EP 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 (3 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-20180291014-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF AVPR1B, C3AR1, RHEB TGFBR1 2423/4885PRMT5 92/4885WDR77 589/4885
US-10787446-B2 Therapeutic compounds and methods of use thereof AVPR1B, C3AR1, RHEB TGFBR1 2423/4885PRMT5 92/4885WDR77 589/4885
US-20210171516-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF AVPR1B, C3AR1, RHEB TGFBR1 2423/4885PRMT5 92/4885WDR77 589/4885

“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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