SCHEMBL1284547

SCHEMBL1284547

Cc1ccc2nc(-c3cc(N4CCC(C(=O)N5CCCCCC5)CC4)ccc3F)[nH]c2c1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.58
TP53 P04637 1/20 0.49
KCNH2 Q12809 4/20 0.46
SSTR2 P30874 3/20 0.46
BRD4 O60885 3/20 0.46
ALDH1A1 P00352 1/20 0.45
LMNA P02545 3/20 0.44
DGAT2 Q96PD7 1/20 0.43
FGFR1 P11362 1/20 0.43
FLT1 P17948 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SIRT2 Q8IXJ6 1/20 0.42
SIRT1 Q96EB6 1/20 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
SCHEMBL1284132 0.93 MAPT (0.49) MAPTTP53KCNH2SSTR2BRD4
SCHEMBL1284144 0.93 MAPT (0.49) MAPTTP53KCNH2SSTR2BRD4
SCHEMBL1284530 0.92 MAPT (0.50) MAPTTP53KCNH2SSTR2ALDH1A1
SCHEMBL1625503 0.87 LMNA (0.58) MAPTTP53KCNH2SSTR2ALDH1A1
SCHEMBL1284508 0.85 MAPT (0.46) MAPTTP53KCNH2ALDH1A1LMNA
SCHEMBL1283898 0.85 KCNH2 (0.51) MAPTTP53KCNH2SSTR2BRD4
SCHEMBL1284637 0.85 MAPT (0.49) MAPTTP53KCNH2SSTR2BRD4
SCHEMBL1625200 0.84 DGAT2 (0.47) MAPTTP53KCNH2SSTR2ALDH1A1
SCHEMBL1283909 0.84 MAPT (0.48) MAPTTP53KCNH2BRD4ALDH1A1
SCHEMBL1623592 0.83 LMNA (0.52) MAPTTP53KCNH2ALDH1A1LMNA

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-20120088752-A1 HEDGEHOG PATHWAY ANTAGONISTS AND THERAPEUTIC APPLICATIONS THEREOF SIENA BIOTECH S.P.A. (IT) 2012-04-12 US claimed

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-20120088752-A1 HEDGEHOG PATHWAY ANTAGONISTS AND THERAPEUTIC APPLICATIONS THEREOF SHH, GLI1, SMO MAPT 3104/4885TP53 537/4885KCNH2 4706/4885

“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.