SCHEMBL5582482

SCHEMBL5582482

CC(=O)Nc1ccc2c(c1C)C/C(=C/c1ccccc1)C2=O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.48
AKT1 P31749 2/20 0.47
AKT2 P31751 2/20 0.47
AKT3 Q9Y243 2/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46
MAOB P27338 8/20 0.45
MAOA P21397 5/20 0.45
MIF P14174 2/20 0.45
CYP19A1 P11511 4/20 0.41
TNF P01375 1/20 0.40

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
SCHEMBL14524731 1.00 TYR (0.48) TYRAKT1AKT2AKT3NPC1
SCHEMBL5582483 1.00 TYR (0.48) TYRAKT1AKT2AKT3NPC1
SCHEMBL5581891 0.88 MAOA (0.47) TYRNPC1RAB9AKMT2AMAOB
SCHEMBL5581887 0.88 MAOA (0.47) TYRNPC1RAB9AKMT2AMAOB
SCHEMBL14524718 0.88 MAOA (0.47) TYRNPC1RAB9AKMT2AMAOB
SCHEMBL6997465 0.74 MAOA (0.62) NPC1RAB9AKMT2AMAOBMAOA
SCHEMBL7703579 0.74 MAOA (0.62) NPC1RAB9AKMT2AMAOBMAOA
SCHEMBL1658824 0.67 BAZ2B (0.43) NPC1RAB9AMAOA
SCHEMBL5582281 0.65 HDAC1 (0.43) MAOBCYP19A1
SCHEMBL27579110 0.65 KMT2A (0.42) AKT1AKT2AKT3NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070087346-A1 Orthogonal gene switches CILIBERTO GENNARO 2007-04-19 US disclosed
EP-1680447-A2 ORTHOGONAL GENE SWITCHES ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2006-07-19 EP disclosed
WO-2005040212-A2 ORTHOGONAL GENE SWITCHES ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2005-05-06 WO 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-20070087346-A1 Orthogonal gene switches TCF12, JUN, TCF7 TYR 3418/4885AKT1 4247/4885AKT2 3924/4885

“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.