SCHEMBL3281222

SCHEMBL3281222

O=C(O)c1ccc2c(c1)CN(C(=O)c1cccc3ccccc13)CC2

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.53
SMN1; SMN2 Q16637 4/20 0.51
HPGD P15428 5/20 0.50
KDM4E B2RXH2 3/20 0.50
ALOX15 P16050 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PTGDR Q13258 4/20 0.49
PTGDR2 Q9Y5Y4 4/20 0.49
PTGER2 P43116 3/20 0.49
CYP2C9 P11712 2/20 0.49
ALDH1A1 P00352 5/20 0.49
LMNA P02545 2/20 0.49
TMPRSS2 O15393 1/20 0.48
HTT P42858 2/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C19 P33261 1/20 0.48
POLB P06746 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
KMT2A Q03164 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
SCHEMBL1263715 0.84 HDAC6 (0.59) KDM4EALDH1A1LMNATMPRSS2TAAR1
SCHEMBL3095946 0.83 HPGD (0.71) MYCSMN1; SMN2HPGDKDM4EALOX15
SCHEMBL6618191 0.83 ALDH1A1 (0.49) ALDH1A1LMNAHTTPOLBKMT2A
SCHEMBL27478801 0.82 ALDH1A1 (0.46) MYCSMN1; SMN2HPGDKDM4EALOX15
SCHEMBL3281765 0.82 MYC (0.49) MYCSMN1; SMN2HPGDKDM4EALOX15
SCHEMBL6619460 0.82 ALDH1A1 (0.48) HPGDPTGDRPTGDR2PTGER2CYP2C9
SCHEMBL3281279 0.81 MYC (0.58) MYCSMN1; SMN2HPGDKDM4EALDH1A1
SCHEMBL3286985 0.81 CYP2C9 (0.49) MYCKDM4EPTGDR2CYP2C9POLB
SCHEMBL1263079 0.80 HDAC6 (0.66) ALDH1A1LMNATMPRSS2
SCHEMBL3281507 0.79 HDAC6 (0.69) MYCSMN1; SMN2HPGDALDH1A1LMNA

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-7705017-B2 Compounds for treatment of neurodegenerative diseases EN VIVO PHARMACEUTICALS, INC. (US) 2010-04-27 US disclosed
US-20060004041-A1 Compounds for treatment of neurodegenerative diseases ENVIVO PHARMACEUTICALS, INC. 2006-01-05 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-20060004041-A1 Compounds for treatment of neurodegenerative diseases HDAC5, HDAC6, HDAC3 MYC 4493/4885SMN1; SMN2 88/4885HPGD 489/4885

“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.