SCHEMBL21887790

SCHEMBL21887790

CCN(C)C(=O)CNC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
GAA P10253 1/20 0.40
CA12 O43570 4/20 0.39
CA1 P00915 3/20 0.39
CA14 Q9ULX7 2/20 0.39
CA7 P43166 1/20 0.39
CA2 P00918 3/20 0.36
CA9 Q16790 2/20 0.36
CTSK P43235 2/20 0.36
CTSS P25774 2/20 0.36
EPHX1 P07099 1/20 0.36
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL19981641 0.84 ALDH1A1 (0.46) MEN1KMT2AALDH1A1TSHRTDP1
SCHEMBL9017483 0.83 CA12 (0.42) MEN1KMT2AALDH1A1TSHRTDP1
SCHEMBL1328516 0.83 TDP1 (0.46) MEN1KMT2AALDH1A1TSHRTDP1
SCHEMBL1456111 0.83 MEN1 (0.41) MEN1KMT2AALDH1A1TSHRTDP1
SCHEMBL5769516 0.83 TDP1 (0.47) MEN1KMT2AALDH1A1TDP1MAOA
SCHEMBL9055377 0.82 CA12 (0.46) MEN1KMT2AALDH1A1TSHRTDP1
SCHEMBL3683152 0.81 TDP1 (0.44) MEN1KMT2AALDH1A1TSHRTDP1
SCHEMBL31270901 0.81 CA12 (0.43) MEN1KMT2AALDH1A1TSHRTDP1
SCHEMBL21716653 0.80 ALDH1A1 (0.42) MEN1KMT2AALDH1A1TSHRTDP1
SCHEMBL31271463 0.80 CTSS (0.40) MEN1KMT2AALDH1A1TSHRTDP1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3894412-B1 7-(METHYLAMINO)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE DERIVATIVES LILLY CO ELI (US) 2023-02-08 EP disclosed
EP-3849981-B1 PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF PSORIASIS AND SYSTEMIC LUPUS ERYTHEMATOSUS LILLY CO ELI (US) 2023-02-01 EP disclosed
WO-2021162942-A1 7-(METHYLAMINO)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE COMPOUNDS ELI LILLY AND COMPANY (US) 2021-08-19 WO disclosed
WO-2020123225-A1 7-(METHYLAMINO)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2020-06-18 WO disclosed
WO-2020055636-A1 PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF PSORIASIS AND SYSTEMIC LUPUS ERYTHEMATOSUS ELI LILLY AND COMPANY (US) 2020-03-19 WO disclosed