SCHEMBL9962898

SCHEMBL9962898

Cc1ccc(OC(=O)N2CCc3c([nH]c4ccc(Cl)cc34)C2c2ccc(OCCCN(CCO)CCO)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 6/20 0.46
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KIF11 P52732 10/20 0.44
SIRT1 Q96EB6 1/20 0.44
ABCG2 Q9UNQ0 2/20 0.42
LMNA P02545 3/20 0.42

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
SCHEMBL9962063 0.95 MAPT (0.46) TP53MAPTSMN1; SMN2KIF11SIRT1
SCHEMBL9962088 0.95 MAPT (0.46) TP53MAPTSMN1; SMN2KIF11SIRT1
SCHEMBL8403146 0.92 TP53 (0.47) TP53MAPTSMN1; SMN2KIF11SIRT1
SCHEMBL9962090 0.91 TP53 (0.43) TP53MAPTSMN1; SMN2KIF11SIRT1
SCHEMBL9962093 0.90 TP53 (0.47) TP53MAPTSMN1; SMN2KIF11SIRT1
SCHEMBL8404211 0.90 TP53 (0.49) TP53MAPTSMN1; SMN2KIF11SIRT1
SCHEMBL8404210 0.90 TP53 (0.48) TP53MAPTSMN1; SMN2KIF11SIRT1
SCHEMBL764664 0.89 TP53 (0.48) TP53MAPTSMN1; SMN2KIF11SIRT1
SCHEMBL12979318 0.89 TP53 (0.45) TP53MAPTSMN1; SMN2KIF11SIRT1
SCHEMBL8403136 0.88 TP53 (0.49) TP53MAPTSMN1; SMN2KIF11SIRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120178707-A1 METHODS FOR TREATING PROSTRATE CONDITIONS PTC THERAPEUTICS, INC. 2012-07-12 US disclosed
US-20120178707-A1 METHODS FOR TREATING PROSTRATE CONDITIONS PTC THERAPEUTICS, INC. 2012-07-12 US disclosed
US-20120157400-A1 METHODS FOR TREATING KAPOSI SARCOMA PTC THERAPEUTICS, INC. 2012-06-21 US disclosed
US-20120157402-A1 METHODS FOR TREATING BRAIN TUMORS PTC THERAPEUTICS, INC. 2012-06-21 US disclosed
US-20120157402-A1 METHODS FOR TREATING BRAIN TUMORS PTC THERAPEUTICS, INC. 2012-06-21 US disclosed
US-20120157400-A1 METHODS FOR TREATING KAPOSI SARCOMA PTC THERAPEUTICS, INC. 2012-06-21 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 (3 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-20120157402-A1 METHODS FOR TREATING BRAIN TUMORS HDGF, VEGFA, FLT4 TP53 61/4885MAPT 1046/4885SMN1; SMN2 2143/4885
US-20120157400-A1 METHODS FOR TREATING KAPOSI SARCOMA HDGF, HIF1AN, VEGFA TP53 17/4885MAPT 3684/4885SMN1; SMN2 2479/4885
US-20120178707-A1 METHODS FOR TREATING PROSTRATE CONDITIONS ACP3, BPHL, PTGFR TP53 380/4885MAPT 1384/4885SMN1; SMN2 4698/4885

“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.