SCHEMBL4680438

SCHEMBL4680438

OC1(c2ccc(Cl)c(Cl)c2)CCN(Cc2ccccc2)C1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.70
KMT2A Q03164 1/20 0.70
CCR3 P51677 1/20 0.60
OPRL1 P41146 6/20 0.58
POLB P06746 1/20 0.57
DRD4 P21917 4/20 0.55
DRD3 P35462 4/20 0.55
DRD2 P14416 3/20 0.55
TACR1 P25103 1/20 0.54
SIGMAR1 Q99720 1/20 0.52
OPRM1 P35372 2/20 0.50

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
SCHEMBL30596349 1.00 KDM4E (0.70) KDM4EKMT2ACCR3OPRL1POLB
SCHEMBL8969668 0.92 KDM4E (0.60) KDM4EKMT2ACCR3OPRL1POLB
SCHEMBL13543993 0.92 CCR3 (0.72) KDM4EKMT2ACCR3OPRL1POLB
Hydrochloric Acid SCHEMBL8563831 0.91 KDM4E (0.62) KDM4EKMT2ACCR3OPRL1POLB
SCHEMBL667088 0.85 ALDH1A1 (0.57) KDM4EKMT2ACCR3OPRL1DRD4
SCHEMBL29087358 0.85 CCR3 (0.83) KDM4EKMT2ACCR3OPRL1POLB
SCHEMBL10226080 0.84 OPRL1 (0.81) KDM4EKMT2ACCR3OPRL1POLB
SCHEMBL1820347 0.83 KDM4E (0.69) KDM4EKMT2ACCR3OPRL1POLB
SCHEMBL8298555 0.82 TACR1 (0.75) KDM4EKMT2ACCR3OPRL1POLB
SCHEMBL3115662 0.82 DRD2 (0.49) KDM4EKMT2AOPRL1DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174611-A1 SUBSTITUTED CYCLIC MODULATORS OF PROTEIN PHOSPHATASE 2A (PP2A) AND METHODS USING SAME RAPPTA THERAPEUTICS OY (FI) 2024-05-30 US disclosed
EP-4288414-A1 SUBSTITUTED CYCLIC MODULATORS OF PROTEIN PHOSPHATASE 2A (PP2A) AND METHODS USING SAME Rappta Therapeutics Oy (FI) 2023-12-13 EP disclosed
CN-116806217-A Substituted cyclic modulators of protein phosphatase 2A (PP 2A) and methods of use thereof 拉帕塔疗法公司 2023-09-26 CN disclosed
WO-2022167867-A1 SUBSTITUTED CYCLIC MODULATORS OF PROTEIN PHOSPHATASE 2A (PP2A) AND METHODS USING SAME RAPPTA THERAPEUTICS OY (FI) 2022-08-11 WO disclosed
EP-1569933-B1 PYRROLIDINE AND AZETIDINE COMPOUNDS AS CCR5 ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2008-07-23 EP disclosed
US-7271172-B2 Pyrrolidine and azetidine compounds as CCR5 antagonists SMITHKLINE BEECHAM CORPORATION (US) 2007-09-18 US disclosed
US-7271172-B2 Pyrrolidine and azetidine compounds as CCR5 antagonists SMITHKLINE BEECHAM CORPORATION (US) 2007-09-18 US disclosed
US-7271172-B2 Pyrrolidine and azetidine compounds as CCR5 antagonists SMITHKLINE BEECHAM CORPORATION (US) 2007-09-18 US disclosed
US-20060058284-A1 Pyrrolidine and azetidine compounds as ccr5 antagonists SMITHKLINE BEECHAM CORPORATION 2006-03-16 US disclosed
EP-1569933-A1 PYRROLIDINE AND AZETIDINE COMPOUNDS AS CCR5 ANTAGONISTS SmithKline Beecham Corporation (US) 2005-09-07 EP disclosed
WO-2004055016-A1 PYRROLIDINE AND AZETIDINE COMPOUNDS AS CCR5 ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2004-07-01 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-20060058284-A1 Pyrrolidine and azetidine compounds as ccr5 antagonists CCR5, CCL5, CXCR1 KDM4E 2781/4885KMT2A 4300/4885CCR3 15/4885
US-20240174611-A1 SUBSTITUTED CYCLIC MODULATORS OF PROTEIN PHOSPHATASE 2A (PP2A) AND METHODS USING SAME PPP2CA, PPP3CA, PPP4C KDM4E 1681/4885KMT2A 1219/4885CCR3 3799/4885

“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.