SCHEMBL10083153

SCHEMBL10083153

C=Cc1ccc(-c2cccc(-c3cccc(-c4nc5ccc(-c6nc7ccc(N8CCN(C)CC8)cc7[nH]6)cc5[nH]4)c3)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.66
SMN1; SMN2 Q16637 4/20 0.66
TOP1 P11387 3/20 0.66
TOP2A P11388 3/20 0.66
HPGD P15428 1/20 0.66
HSD17B10 Q99714 1/20 0.66
KDM4E B2RXH2 2/20 0.65
NPC1 O15118 1/20 0.65
POLB P06746 1/20 0.65
RAB9A P51151 1/20 0.65
MEN1 O00255 2/20 0.60
MAPT P10636 2/20 0.60
BLM P54132 2/20 0.60
KMT2A Q03164 2/20 0.60
SLCO2B1 O94956 1/20 0.60
GLA P06280 1/20 0.60
RECQL P46063 1/20 0.60
BCL2L1 Q07817 1/20 0.60
SLCO1B3 Q9NPD5 1/20 0.60
TDP1 Q9NUW8 1/20 0.60

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
SCHEMBL10083152 0.89 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2TOP1TOP2AHPGD
SCHEMBL14656343 0.88 ALDH1A1 (0.80) ALDH1A1SMN1; SMN2TOP1TOP2AHPGD
SCHEMBL14399402 0.85 ALDH1A1 (0.80) ALDH1A1SMN1; SMN2TOP1TOP2AHPGD
SCHEMBL26252728 0.83 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2TOP1TOP2AHPGD
SCHEMBL12101904 0.83 ALDH1A1 (0.81) ALDH1A1SMN1; SMN2TOP1TOP2AHPGD
SCHEMBL10082670 0.81 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2TOP1TOP2AHPGD
SCHEMBL25138200 0.81 ALDH1A1 (0.70) ALDH1A1SMN1; SMN2TOP1TOP2AHPGD
SCHEMBL18973765 0.80 DGAT1 (0.74) ALDH1A1SMN1; SMN2TOP1TOP2AHPGD
SCHEMBL18595033 0.80 SMN1; SMN2 (0.77) ALDH1A1SMN1; SMN2TOP1TOP2AHPGD
SCHEMBL8769012 0.80 ALDH1A1 (0.72) ALDH1A1SMN1; SMN2TOP1TOP2AHPGD

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-8097238-B2 Cell targeting conjugates PETER MACCALLUM CANCER INSTITUTE (AU) 2012-01-17 US disclosed
US-20070140970-A1 Cell targeting conjugates PETER MACCALLUM CANCER INSTITUTE 2007-06-21 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-20070140970-A1 Cell targeting conjugates CD47, CD74, CD2 ALDH1A1 1727/4885SMN1; SMN2 3773/4885TOP1 158/4885

“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.