SCHEMBL2214441

SCHEMBL2214441

CNCCc1cc(Cl)ccc1OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 11/20 0.53
KMT2A Q03164 1/20 0.52
CARM1 Q86X55 2/20 0.51
PRMT1 Q99873 2/20 0.51
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
STAT3 P40763 1/20 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
SCHEMBL2214436 0.86 KMT2A (0.52) PTGER1KMT2AKDM4EALDH1A1LMNA
SCHEMBL27632935 0.83 KMT2A (0.52) PTGER1KMT2ASTAT3
SCHEMBL7650855 0.82 HTR1A (0.67) KMT2ACARM1PRMT1KDM4EALDH1A1
SCHEMBL693828 0.81 PTGER1 (0.53) PTGER1KMT2ASTAT3
SCHEMBL1382344 0.80 PTGER1 (0.54) PTGER1KMT2AALDH1A1LMNA
SCHEMBL1382347 0.80 PTGER1 (0.54) PTGER1KMT2AALDH1A1LMNA
SCHEMBL4720836 0.79 PTGER1 (0.56) PTGER1STAT3
SCHEMBL562155 0.78 PTGER1 (0.55) PTGER1STAT3
SCHEMBL2954443 0.78 MAPT (0.60) PTGER1
SCHEMBL1196687 0.78 CCR5 (0.64) PTGER1KMT2ASTAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1832928-B 5-membered heterocycle-based p38 kinase inhibitors NOVARTIS AG (CH) 2012-07-04 CN claimed
EP-1641764-B1 5-MEMBERED HETEROCYCLE-BASED P38 KINASE INHIBITORS NOVARTIS AG (CH) 2011-07-27 EP claimed
CN-1832928-A 5-membered heterocycle-based p38 kinase inhibitors NOVARTIS AG (CH) 2006-09-13 CN claimed
US-20050049288-A1 5-MEMBERED HETEROCYCLE-BASED p38 KINASE INHIBITORS MEREO BIOPHARMA 1 LIMINTED (GB) 2005-03-03 US claimed

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-20050049288-A1 5-MEMBERED HETEROCYCLE-BASED p38 KINASE INHIBITORS MAPK1, MAP3K1, MAP3K8 PTGER1 702/4885KMT2A 3472/4885CARM1 2629/4885

“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.