SCHEMBL4712460

SCHEMBL4712460

O=C(c1cc2c(ccc(=O)n2-c2ccccc2)n1Cc1cccc(Cl)c1)N1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.51
PTGS1 P23219 1/20 0.51
BRD4 O60885 1/20 0.51
CCR2 P41597 1/20 0.47
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 2/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CHRM2 P08172 1/20 0.43
CHRM3 P20309 1/20 0.43
POLB P06746 3/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TP53 P04637 3/20 0.41

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
SCHEMBL5119050 0.87 CCR2 (0.62) CCR2MAPT
SCHEMBL4715213 0.85 CCR2 (0.51) BRD4CCR2LMNAALDH1A1KMT2A
SCHEMBL4717022 0.83 CCR2 (0.49) BRD4CCR2LMNASMN1; SMN2ALDH1A1
SCHEMBL4711188 0.83 BRD4 (0.53) BRD4CCR2LMNASMN1; SMN2ALDH1A1
SCHEMBL4715185 0.82 BRD4 (0.48) BRD4CCR2LMNASMN1; SMN2ALDH1A1
SCHEMBL4712174 0.80 MAPT (0.51) BRD4CCR2LMNASMN1; SMN2ALDH1A1
SCHEMBL4714910 0.80 CCR2 (0.46) BRD4CCR2LMNAALDH1A1MAPT
SCHEMBL4715116 0.79 CCR2 (0.55) BRD4CCR2MAPTTP53
SCHEMBL4714899 0.78 ALDH1A1 (0.49) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL4715522 0.76 RGS4 (0.48) BRD4CCR2LMNAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7456286-B2 Bicyclic heteroaromatic compounds as kinase inhibitors UCB PHARMA, S.A. (BE) 2008-11-25 US claimed
US-20060122212-A1 Bicyclic heteroaromatic compounds as kinase inhibitors CELLTECH R&D LIMITED (GB) 2006-06-08 US claimed
US-7456286-B2 Bicyclic heteroaromatic compounds as kinase inhibitors UCB PHARMA, S.A. (BE) 2008-11-25 US disclosed
EP-1549648-B1 BICYCLIC HETEROAROMATIC COMPOUNDS AS KINASE INHIBITORS UCB PHARMA SA (BE) 2008-11-12 EP disclosed
US-20060122212-A1 Bicyclic heteroaromatic compounds as kinase inhibitors CELLTECH R&D LIMITED (GB) 2006-06-08 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 (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-20060122212-A1 Bicyclic heteroaromatic compounds as kinase inhibitors MAP2K2, MAP2K7, MAP2K3 PTGS2 479/4885PTGS1 405/4885BRD4 241/4885

“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.