SCHEMBL3155704

SCHEMBL3155704

CC(C)(C)OC(=O)N1CCC(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 3/20 0.56
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
NPSR1 Q6W5P4 3/20 0.53
USP2 O75604 1/20 0.53
HPGD P15428 1/20 0.53
HSD17B10 Q99714 1/20 0.53
KDM4E B2RXH2 1/20 0.52
PKM P14618 1/20 0.52
FAAH O00519 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
HTT P42858 1/20 0.52
LMNA P02545 2/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
VEGFA P15692 1/20 0.50
EGLN1 Q9GZT9 1/20 0.50
NR1D1 P20393 1/20 0.50
TP53 P04637 1/20 0.49
CCR3 P51677 1/20 0.48

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
SCHEMBL22532739 0.90 KDM4E (0.52) STSKDM4EPKMLMNATP53
SCHEMBL20015397 0.88 FAAH (0.66) STSMEN1KMT2ANPSR1USP2
SCHEMBL16113579 0.88 GPR119 (0.61) MEN1KMT2AKDM4EPKMFAAH
SCHEMBL12263494 0.88 KDM4E (0.53) KDM4EPKMTP53GPR119
SCHEMBL2250178 0.88 GPR119 (0.60) KDM4EPKMALDH1A1TP53GPR119
SCHEMBL13717007 0.87 KDM4E (0.53) MEN1KMT2AKDM4EPKMTP53
SCHEMBL3145386 0.87 KDM4E (0.52) STSKDM4EPKMLMNATP53
SCHEMBL4773737 0.87 KDM4E (0.52) KDM4EPKMHTTALDH1A1TP53
SCHEMBL578839 0.87 FPR2 (0.53) KDM4EPKMTP53CCR3GPR119
SCHEMBL4773466 0.87 TP53 (0.54) MEN1KMT2AKDM4EPKMLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024028808-A1 AROMATIC COMPOUNDS FOR USE AS PROTEIN PHOSPHATASE 2A (PP2A) MODULATORS RAPPTA THERAPEUTICS OY (FI) 2024-02-08 WO disclosed
US-20170158702-A1 MULTIVALENT RAS BINDING COMPOUNDS KYRAS THERAPEUTICS, INC. 2017-06-08 US disclosed
EP-1465631-B1 PYRIMIDINE A2B SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE OSI PHARM INC (US) 2010-02-24 EP disclosed
US-7501407-B2 Pyrimidine A2B selective antagonist compounds, their synthesis and use OSI PHARMACEUTICALS, INC. (US) 2009-03-10 US disclosed
EP-1453804-B1 CCR-3 RECEPTOR ANTAGONISTS VII HOFFMANN LA ROCHE (CH) 2007-08-22 EP disclosed
EP-1453804-B1 CCR-3 RECEPTOR ANTAGONISTS VII HOFFMANN LA ROCHE (CH) 2007-08-22 EP disclosed
US-7019007-B2 CCR-3 receptor antagonists (I) SYNTEX (U.S.A.) LLC (US) 2006-03-28 US disclosed
US-6977265-B2 Piperidine CCR-3 receptor antagonists ROCHE PALO ALTO LLC (US) 2005-12-20 US disclosed
US-6916804-B2 Pyrimidine A2b selective antagonist compounds, their synthesis and use OSI PHARMACEUTICALS, INC. (US) 2005-07-12 US disclosed
US-20050119271-A1 Pyrimidine A2B selective antagonist compounds, their synthesis and use OSI PHARMACEUTICALS, INC. 2005-06-02 US disclosed
EP-1453804-A2 CCR-3 RECEPTOR ANTAGONISTS VII F. Hoffmann-La Roche AG (CH) 2004-09-08 EP disclosed
EP-1453825-A1 N-UREIDO-PIPERIDINES AS ANTAGONISTS VIII FOR CCR-3 RECEPTOR F. HOFFMANN-LA ROCHE AG (CH) 2004-09-08 EP disclosed
US-20030229121-A1 Piperidine CCR-3 receptor antagonists SYNTEX (U.S.A.) LLC 2003-12-11 US disclosed
US-20030162764-A1 Pyrimidine A2b selective antagonist compounds, their synthesis and use OSI PHARMACEUTICALS, INC. 2003-08-28 US disclosed
US-20030153578-A1 CCR-3 receptor antagonists (I) SYNTEX (U.S.A.) LLC 2003-08-14 US disclosed
WO-2003045917-A2 CCR-3 RECEPTOR ANTAGONISTS VII F. HOFFMANN-LAROCHE AG (CH) 2003-06-05 WO disclosed
WO-2003045937-A1 N-UREIDO-PIPERIDINES AS ANTAGONISTS VIII FOR CCR-3 RECEPTOR F. HOFFMANN-LA ROCHE AG (CH) 2003-06-05 WO disclosed
US-20030018038-A1 1,4 substituted piperidinyl NMDA/NR2B antagonists MERCK & CO., INC. 2003-01-23 US disclosed
US-6476041-B1 1,4 substituted piperidinyl NMDA/NR2B antagonists MERCK & CO., INC. 2002-11-05 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 (6 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-20030229121-A1 Piperidine CCR-3 receptor antagonists CCR1, CCR3, CCRL2 STS 4803/4885MEN1 4556/4885KMT2A 3093/4885
US-20050119271-A1 Pyrimidine A2B selective antagonist compounds, their synthesis and use ADORA2B, ADORA2A, ADORA3 STS 2383/4885MEN1 4340/4885KMT2A 2079/4885
US-20030018038-A1 1,4 substituted piperidinyl NMDA/NR2B antagonists GRIN1, GRIN2A, GRIN2B STS 4637/4885MEN1 4657/4885KMT2A 705/4885
US-20170158702-A1 MULTIVALENT RAS BINDING COMPOUNDS KRAS, HRAS, NRAS STS 4608/4885MEN1 769/4885KMT2A 3584/4885
US-20030162764-A1 Pyrimidine A2b selective antagonist compounds, their synthesis and use ADORA2B, ADORA2A, ADORA3 STS 1622/4885MEN1 4670/4885KMT2A 2134/4885
US-20030153578-A1 CCR-3 receptor antagonists (I) CCR1, CCR3, CCR4 STS 4814/4885MEN1 4093/4885KMT2A 3017/4885

“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.