SCHEMBL4501990

SCHEMBL4501990

COC(=O)c1ccc2[nH]c(NCC3(F)CCN(Cc4cc(Cl)cc(Cl)c4O)CC3)nc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
GFER P55789 1/20 0.42
KDM1A O60341 2/20 0.40
MAOB P27338 1/20 0.40
ALDH1A1 P00352 5/20 0.37
SSTR5 P35346 3/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
CASP1 P29466 1/20 0.36
POLB P06746 1/20 0.35
MLLT1 Q03111 1/20 0.35
HTR1A P08908 1/20 0.35
TSHR P16473 1/20 0.35
CSNK1E P49674 1/20 0.34
USP7 Q93009 1/20 0.34

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
SCHEMBL4501997 0.94 MEN1 (0.42) MEN1KMT2AGFERKDM1AMAOB
SCHEMBL4496934 0.78 MEN1 (0.46) MEN1KMT2AGFERALDH1A1LMNA
SCHEMBL4496248 0.78 CSNK1E (0.43) MEN1KMT2AALDH1A1LMNAHTT
SCHEMBL4502209 0.78 MEN1 (0.42) MEN1KMT2AGFERMAOBALDH1A1
Hydrochloric Acid SCHEMBL4496242 0.77 CSNK1E (0.42) MEN1KMT2AALDH1A1LMNAHTT
SCHEMBL4497494 0.76 PKM (0.44) CSNK1E
Hydrochloric Acid SCHEMBL4496250 0.70 ALDH1A1 (0.49) ALDH1A1LMNAHTTKDM4EMLLT1
SCHEMBL4497501 0.69 KDM4E (0.45) ALDH1A1LMNAHTTKDM4E
SCHEMBL4504259 0.68 RIPK1 (0.47) MEN1KMT2AGFERALDH1A1LMNA
SCHEMBL4490825 0.66 LMNA (0.46) MEN1KMT2AALDH1A1SSTR5LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524841-B2 4,4-disubstituted piperidine derivatives having CCR3 antagonism TEIJIN LIMITED (JP) 2009-04-28 US disclosed
US-20070037851-A1 Inhibits binding of CCR3 ligands such as eotaxins to their target cells; inhibits physiological effects of binding; therapeutic and prophylactic agents for asthma, rhinitis, dermatitis, urticaria, conjunctivitis, inflammatory bowel; tissue infiltration of eosinophils, basophils, activated T cells TEIJIN LIMITED, A JAPANESE BODY CORPORATE (JP) 2007-02-15 US disclosed
EP-1505067-A1 4,4-DISUBSTITUTED PIPERIDINE DERIVATIVES HAVING CCR3 ANTAGONISM TEIJIN LIMITED (JP) 2005-02-09 EP 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-20070037851-A1 Inhibits binding of CCR3 ligands such as eotaxins to their target cells; inhibits physiological effects of binding; therapeutic and prophylactic agents for asthma, rhinitis, dermatitis, urticaria, conjunctivitis, inflammatory bowel; tissue infiltration of eosinophils, basophils, activated T cells CCR3, CCR1, CCR4 MEN1 4549/4885KMT2A 4002/4885GFER 4149/4885

“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.