SCHEMBL19282962

SCHEMBL19282962

CC(C)(C)OC(=O)NC1(c2ccc(-c3ccc(C(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 9/20 0.46
AKT1 P31749 1/20 0.44
P2RY14 Q15391 1/20 0.42
RORC P51449 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
PTGER4 P35408 3/20 0.41
PTGER2 P43116 1/20 0.41
OPRM1 P35372 1/20 0.40
OPRL1 P41146 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
APP P05067 1/20 0.39
MAPT P10636 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
SCHEMBL25156379 0.85 AKT1 (0.51) PDE2AAKT1HDAC1PPARGPPARA
SCHEMBL22686802 0.80 AKT1 (0.41) PDE2AAKT1P2RY14RORCHDAC3
SCHEMBL19282949 0.80 PDE2A (0.51) PDE2AHDAC3HDAC1HDAC2HDAC6
SCHEMBL18551335 0.80 MIF (0.46) PDE2AAKT1RORC
SCHEMBL12196127 0.79 DRD2 (0.53) PDE2AAKT1HDAC3HDAC1HDAC2
SCHEMBL2588632 0.79 NPC1 (0.47) PDE2AAKT1RORC
SCHEMBL5640967 0.79 AKT1 (0.43) PDE2AAKT1RORCOPRM1
SCHEMBL23778486 0.79 AKT1 (0.45) PDE2AAKT1
SCHEMBL14236180 0.79 AKT1 (0.43) PDE2AAKT1RORC
SCHEMBL4087871 0.79 AKT1 (0.43) PDE2AAKT1RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170247336-A1 SUBSTITUTED PYRIMIDINES AS INHIBITORS OF HIF PROLYL HYDROXYLASE MERCK SHARP & DOHME CORP. (US) 2017-08-31 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 (1 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-20170247336-A1 SUBSTITUTED PYRIMIDINES AS INHIBITORS OF HIF PROLYL HYDROXYLASE HIF1AN, HIF1A, EGLN2 PDE2A 962/4885AKT1 2274/4885P2RY14 1973/4885

“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.