SCHEMBL12530833

SCHEMBL12530833

CC(C)OCCCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.61
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
HDAC7 Q8WUI4 1/20 0.56
MAOB P27338 3/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
CYP1A2 P05177 2/20 0.51
CYP2C19 P33261 2/20 0.51
CYP2D6 P10635 1/20 0.51
MEN1 O00255 1/20 0.51
CHRM2 P08172 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL19370107 0.95 MAPT (0.55) MAPTRAB9ASMN1; SMN2HDAC7MAOB
SCHEMBL31006340 0.95 MAPT (0.55) MAPTRAB9ASMN1; SMN2HDAC7MAOB
SCHEMBL12459480 0.90 L3MBTL1 (0.58) MAPTRAB9ASMN1; SMN2MAOBL3MBTL1
SCHEMBL12452818 0.90 MAPT (0.50) MAPTRAB9ASMN1; SMN2HDAC7MAOB
SCHEMBL25040676 0.84 L3MBTL1 (0.53) MAPTRAB9ASMN1; SMN2MAOBL3MBTL1
SCHEMBL30274345 0.84 L3MBTL1 (0.53) MAPTRAB9ASMN1; SMN2MAOBL3MBTL1
SCHEMBL10343975 0.83 MAPT (0.61) MAPTRAB9ASMN1; SMN2HDAC7L3MBTL1
SCHEMBL25144719 0.82 MAPT (0.46) MAPTRAB9ASMN1; SMN2HDAC7L3MBTL1
SCHEMBL10719302 0.81 RAB9A (0.67) MAPTRAB9ASMN1; SMN2CYP1A2CYP2C19
SCHEMBL18522763 0.81 SMN1; SMN2 (0.58) MAPTRAB9ASMN1; SMN2HDAC7L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220169660-A1 CYCLIC AMINO-PYRAZINECARBOXAMIDE COMPOUNDS AND USES THEREOF SILVERBACK THERAPEUTICS INC (US) 2022-06-02 US disclosed
US-20110160196-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2011-06-30 US disclosed
US-20110160196-A1 FACTOR XA INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2011-06-30 US disclosed
US-20080293704-A1 FACTOR Xa INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2008-11-27 US disclosed
US-20080293704-A1 FACTOR Xa INHIBITORS MILLENNIUM PHARMACEUTICALS, INC. 2008-11-27 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-20080293704-A1 FACTOR Xa INHIBITORS TFPI, F12, F11 MAPT 4577/4885RAB9A 1789/4885SMN1; SMN2 3156/4885
US-20110160196-A1 FACTOR XA INHIBITORS TFPI, F12, F11 MAPT 4577/4885RAB9A 1789/4885SMN1; SMN2 3156/4885
US-20220169660-A1 CYCLIC AMINO-PYRAZINECARBOXAMIDE COMPOUNDS AND USES THEREOF TGFBR2, ACVR2A, SMAD2 MAPT 3941/4885RAB9A 3009/4885SMN1; SMN2 3980/4885

“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.