SCHEMBL6503239

SCHEMBL6503239

COc1cc(OC)cc(N2CCN(C(=O)c3[nH]cnc3-c3ccccc3)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.56
TP53 P04637 2/20 0.50
LMNA P02545 2/20 0.50
CCKAR P32238 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
RAB9A P51151 1/20 0.47
GFER P55789 1/20 0.46
ALDH1A1 P00352 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HPGD P15428 2/20 0.46
TSHR P16473 1/20 0.45
GAA P10253 2/20 0.45
SMO Q99835 1/20 0.45

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
SCHEMBL6493236 0.92 KDM4E (0.57) KDM4ETP53LMNACCKARTDP1
SCHEMBL6493330 0.84 KDM4E (0.45) KDM4ETP53LMNACCKARTDP1
SCHEMBL1381055 0.82 LMNA (0.52) KDM4ETP53LMNACCKARMAPT
SCHEMBL6495212 0.81 ALDH1A1 (0.56) KDM4ELMNAMAPTSMN1; SMN2NPC1
SCHEMBL1380792 0.80 KDM4E (0.47) KDM4ETP53LMNACCKARMAPT
SCHEMBL6494111 0.79 GFER (0.49) KDM4ETP53TDP1MAPTSMN1; SMN2
SCHEMBL1380400 0.79 LMNA (0.51) KDM4ETP53LMNACCKARMAPT
SCHEMBL1381909 0.79 GFER (0.54) KDM4ELMNATDP1MAPTPOLB
SCHEMBL1381669 0.79 LMNA (0.49) KDM4ETP53LMNAMAPTSMN1; SMN2
SCHEMBL6493336 0.79 KDM4E (0.52) KDM4ETDP1MAPTPOLBGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014765-A1 Aryl-heteroaromatic products, compositions comprising them and use AVENTIS PHARMA S.A. (FR) 2005-01-20 US claimed
US-20050014765-A1 Aryl-heteroaromatic products, compositions comprising them and use AVENTIS PHARMA S.A. (FR) 2005-01-20 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-20050014765-A1 Aryl-heteroaromatic products, compositions comprising them and use AHR, ARNT, MYC KDM4E 1246/4885TP53 19/4885LMNA 3596/4885

“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.