SCHEMBL1064265

SCHEMBL1064265

NC(=O)[C@H]1CCc2cc(Cl)ccc2O1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ATF4 P18848 1/20 0.41
GLS O94925 2/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
POLB P06746 2/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NFKB1 P19838 4/20 0.39
NFKB2 Q00653 4/20 0.39
RELA Q04206 4/20 0.39
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
SIRT1 Q96EB6 2/20 0.38

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
SCHEMBL5847887 0.88 POLB (0.48) CYP4F2CYP4A11MEN1KMT2AATF4
SCHEMBL11471349 0.88 CYP4F2 (0.44) CYP4F2CYP4A11MEN1KMT2AATF4
SCHEMBL5847886 0.88 POLB (0.48) CYP4F2CYP4A11MEN1KMT2AATF4
SCHEMBL5847882 0.88 POLB (0.48) CYP4F2CYP4A11MEN1KMT2AATF4
Hydrochloric Acid SCHEMBL11471350 0.86 POLB (0.47) CYP4F2CYP4A11MEN1KMT2AATF4
SCHEMBL5839879 0.86 ESR1 (0.56) CYP4F2CYP4A11ESR1ESR2NFKB1
SCHEMBL24496756 0.85 MEN1 (0.47) CYP4F2CYP4A11MEN1KMT2AATF4
SCHEMBL23552434 0.84 MEN1 (0.46) CYP4F2CYP4A11MEN1KMT2AATF4
SCHEMBL4672067 0.83 CYP4F2 (0.45) CYP4F2CYP4A11ESR1ESR2SMN1; SMN2
SCHEMBL19520540 0.82 CYP4F2 (0.52) CYP4F2CYP4A11MEN1KMT2AATF4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020223538-A1 SUBSTITUTED CYCLOALKYLS AS MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2020-11-05 WO disclosed
US-20130289086-A1 Aminopyrrolidinone Derivatives and Uses Thereof DUGGAN MARK E (US) 2013-10-31 US disclosed
US-8252829-B2 Aminopyrrolidinone derivatives and uses thereof LINK MEDICINE CORPORATION (US) 2012-08-28 US disclosed
EP-2438059-A1 AMINOPYRROLIDINONE DERIVATIVES AND USES THEREOF Link Medicine Corporation (US) 2012-04-11 EP disclosed
US-20110021590-A1 AMINOPYRROLIDINONE DERIVATIVES AND USES THEREOF LINK MEDICINE CORPORATION (US) 2011-01-27 US disclosed
WO-2010141932-A1 AMINOPYRROLIDINONE DERIVATIVES AND USES THEREOF LINK MEDICINE CORPORATION (US) 2010-12-09 WO 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-20130289086-A1 Aminopyrrolidinone Derivatives and Uses Thereof PRMT1, PRMT5, AGTR2 CYP4F2 1415/4885CYP4A11 481/4885MEN1 1373/4885
US-20110021590-A1 AMINOPYRROLIDINONE DERIVATIVES AND USES THEREOF PRMT1, PRMT5, AGTR2 CYP4F2 1415/4885CYP4A11 481/4885MEN1 1373/4885

“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.