SCHEMBL10238352

SCHEMBL10238352

CN1CCOc2cc(C(=O)Nc3ccc(Cl)c(NC(=O)c4ccccc4)c3)ccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.56
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
MAPT P10636 5/20 0.53
KMT2A Q03164 5/20 0.53
MEN1 O00255 4/20 0.53
ALDH1A1 P00352 3/20 0.53
LMNA P02545 3/20 0.53
HTT P42858 3/20 0.53
POLB P06746 1/20 0.53
MAPK1 P28482 2/20 0.52
NTSR1 P30989 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
MAOB P27338 3/20 0.50
MAPK14 Q16539 1/20 0.50
CHRM1 P11229 1/20 0.50
PTGER3 P43115 1/20 0.49
HDAC1 Q13547 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48

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
SCHEMBL14530572 0.93 SMN1; SMN2 (0.48) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL6125954 0.80 PTGER3 (0.56) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL8773512 0.80 PTGER3 (0.56) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL5493355 0.79 CCR2 (0.63) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL3790049 0.77 MAPT (0.83) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL21254477 0.76 PTGER3 (0.52) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL10238347 0.76 KMT2A (0.63) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL2847600 0.76 PTGER3 (0.49) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL10238477 0.75 RAB9A (0.72) SMN1; SMN2NPC1RAB9AMAPTKMT2A
SCHEMBL17195423 0.75 MAPT (0.56) SMN1; SMN2NPC1RAB9AMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101610-B2 Blocking signals; anticancer agents GENENTECH, INC. (US) 2012-01-24 US disclosed
US-8101610-B2 Blocking signals; anticancer agents GENENTECH, INC. (US) 2012-01-24 US disclosed
US-20080269215-A1 Bisamide Inhibitors of Hedgehog Signaling GENENTECH INC. (US) 2008-10-30 US disclosed
US-20080269215-A1 Bisamide Inhibitors of Hedgehog Signaling GENENTECH INC. (US) 2008-10-30 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-20080269215-A1 Bisamide Inhibitors of Hedgehog Signaling SHH, GLI1, SMO SMN1; SMN2 4415/4885NPC1 2248/4885RAB9A 240/4885

“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.