SCHEMBL7920372

SCHEMBL7920372

C=C1c2ccc(OC)cc2CCc2ccc(Br)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.48
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP26A1 O43174 2/20 0.42
MAPK14 Q16539 2/20 0.42
CYP27A1 Q02318 1/20 0.42
MPO P05164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MIF P14174 2/20 0.41
MAPT P10636 3/20 0.41
CYP19A1 P11511 2/20 0.41
CYP11B2 P19099 2/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
BCL2 P10415 1/20 0.41
PRNP P04156 1/20 0.40
GLA P06280 1/20 0.40
NPC1 O15118 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
SCHEMBL7920369 0.84 TDP1 (0.62) METAP1CYP26A1MAPK14CYP27A1TDP1
SCHEMBL18535881 0.79 METAP1 (0.66) METAP1CYP1A2MPOCYP19A1ALDH1A1
SCHEMBL17978174 0.78 KDM4E (0.51) METAP1MAPK14TDP1L3MBTL1MIF
SCHEMBL7913167 0.78 APP (0.52) METAP1MAPK14TDP1MAPTKDM4E
SCHEMBL8321691 0.78 METAP1 (0.56) METAP1CYP1A2CYP2D6CYP26A1MPO
SCHEMBL19810736 0.77 MAPT (0.52) METAP1CYP1A2MAPK14TDP1L3MBTL1
SCHEMBL7918568 0.75 MAPT (0.53) METAP1MAPK14TDP1MAPTCYP19A1
SCHEMBL17108416 0.75 MPO (0.59) METAP1CYP1A2CYP2D6CYP26A1MPO
SCHEMBL15074186 0.75 CYP26A1 (0.49) METAP1CYP1A2CYP2D6CYP26A1MAPK14
SCHEMBL15395906 0.74 METAP1 (0.54) METAP1MAPK14MAPTCYP19A1CYP11B2

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
EP-2328903-B1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETASECRETASE MODULATORS AND METHODS OF USE AMGEN INC (US) 2014-03-05 EP disclosed
US-8426447-B2 Spiro-tricyclic ring compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2013-04-23 US disclosed
US-8426447-B2 Spiro-tricyclic ring compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2013-04-23 US disclosed
US-20100087429-A1 SPIRO-TRICYCLIC RING COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2010-04-08 US disclosed
US-20100087429-A1 SPIRO-TRICYCLIC RING COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2010-04-08 US disclosed
WO-2010030954-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETASECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2010-03-18 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-20100087429-A1 SPIRO-TRICYCLIC RING COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE BACE1, BACE2, APP METAP1 966/4885CYP1A2 258/4885CYP2D6 755/4885

“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.