SCHEMBL4512157

SCHEMBL4512157

CCOC(CCN)c1ccc(OCc2nc3ccccc3c(=O)n2C)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.61
ALOX15 P16050 1/20 0.61
TSHR P16473 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
PPARG P37231 1/20 0.52
NPC1 O15118 6/20 0.49
PDE10A Q9Y233 2/20 0.49
RAB9A P51151 7/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
GAA P10253 2/20 0.47
ACKR3 P25106 5/20 0.45
FFAR1 O14842 1/20 0.43
MAPT P10636 2/20 0.43
GLA P06280 1/20 0.43
KMT2A Q03164 1/20 0.43
HDAC6 Q9UBN7 1/20 0.42
USP2 O75604 1/20 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
SCHEMBL4027919 0.80 KDM4E (0.61) KDM4EALOX15TSHRTDP1L3MBTL1
SCHEMBL4030636 0.77 FFAR1 (0.53) L3MBTL1PPARGRAB9ASMN1; SMN2GAA
SCHEMBL6555825 0.77 PPARA (0.61) KDM4EALOX15TSHRTDP1L3MBTL1
SCHEMBL4026210 0.76 RAB9A (0.59) TSHRNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL6555798 0.75 KDM4E (0.59) KDM4EALOX15TSHRTDP1L3MBTL1
SCHEMBL4025386 0.75 RAB9A (0.58) TSHRNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL29571968 0.74 KDM4E (0.74) KDM4EALOX15TSHRTDP1L3MBTL1
SCHEMBL5935612 0.74 KDM4E (0.74) KDM4EALOX15TSHRTDP1L3MBTL1
SCHEMBL6555876 0.74 KDM4E (0.58) KDM4EALOX15TSHRTDP1L3MBTL1
SCHEMBL6556023 0.74 TSHR (0.50) KDM4EALOX15TSHRTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275565-A1 Substituted aralkyl derivatives CADILA HEALTHCARE LIMITED (IN) 2009-11-05 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 (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-20090275565-A1 Substituted aralkyl derivatives UGT1A7, UGT1A10, UGT2B7 KDM4E 4614/4885ALOX15 1929/4885TSHR 3987/4885

“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.