SCHEMBL22770523

SCHEMBL22770523

CC(C)(C)OC(=O)N1CCC2(CC1)CNC(=O)N2CC1CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 2/20 0.43
CRBN Q96SW2 2/20 0.43
KDM4E B2RXH2 2/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
FAAH O00519 1/20 0.40
GPR119 Q8TDV5 4/20 0.39
BACE1 P56817 1/20 0.39
NR1H2 P55055 1/20 0.39
PIK3CD O00329 1/20 0.38
PKM P14618 1/20 0.38
CNR2 P34972 1/20 0.38
HPGD P15428 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
NAMPT P43490 1/20 0.37
FPR2 P25090 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
SCHEMBL22576367 0.81 PIK3CD (0.40) PIK3CDNAMPT
SCHEMBL22770572 0.80 GPR119 (0.41) DDB1CRBNKDM4EMAPTTHRB
SCHEMBL17141012 0.80 DDB1 (0.46) DDB1CRBNKDM4EMAPTTHRB
SCHEMBL27090319 0.76 ROCK2 (0.47) MAPTGPR119BACE1
SCHEMBL18940727 0.75 ENPP2 (0.42) DDB1CRBNKDM4EMAPTTHRB
SCHEMBL20873836 0.73 CNR1 (0.51) DDB1CRBNKDM4EMAPTGPR119
SCHEMBL1100404 0.73 CNR1 (0.51) DDB1CRBNKDM4EMAPTGPR119
SCHEMBL5095029 0.71 GPR119 (0.50) MAPTGPR119
SCHEMBL26925652 0.71 GPR119 (0.45) DDB1CRBNGPR119NR1H2HPGD
SCHEMBL8893259 0.70 SLC6A9 (0.50) DDB1CRBNKDM4EMAPTTHRB

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-3727378-B1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA MERCK SHARP & DOHME LLC (US) 2023-02-22 EP disclosed
US-11179389-B2 Purine inhibitors of human phosphatidylinositol 3-kinase delta MERCK SHARP & DOHME CORP. (US) 2021-11-23 US disclosed
US-11179389-B2 Purine inhibitors of human phosphatidylinositol 3-kinase delta MERCK SHARP & DOHME CORP. (US) 2021-11-23 US disclosed
US-20200390760-A1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA MERCK SHARP & DOHME CORP. (US) 2020-12-17 US disclosed
US-20200390760-A1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA MERCK SHARP & DOHME CORP. (US) 2020-12-17 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-20200390760-A1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PI4KA DDB1 2061/4885CRBN 3971/4885KDM4E 4298/4885
US-11179389-B2 Purine inhibitors of human phosphatidylinositol 3-kinase delta PIK3CD, PIK3CA, PI4KA DDB1 2061/4885CRBN 3971/4885KDM4E 4298/4885

“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.