SCHEMBL1997006

SCHEMBL1997006

C=C1c2cc(OC)ccc2Oc2ncc(Br)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.36
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
DYRK1B Q9Y463 1/20 0.34
NPC1 O15118 1/20 0.34
NCOA1 Q15788 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
SYK P43405 1/20 0.32
AURKA O14965 1/20 0.32
DAPK3 O43293 1/20 0.32
STK17B O94768 1/20 0.32
GSK3B P49841 1/20 0.32
BLK P51451 1/20 0.32
CDK5 Q00535 1/20 0.32
TEK Q02763 1/20 0.32

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
SCHEMBL2000611 0.82 APP (0.41) SMN1; SMN2NPC1NCOA1NCOA3AURKA
SCHEMBL2371967 0.80
SCHEMBL2371422 0.69 BACE1 (0.40) EGFRHTTSMN1; SMN2POLBRAB9A
SCHEMBL7918568 0.68 MAPT (0.53) SMN1; SMN2RAB9ANPC1ALDH1A1HPGD
SCHEMBL7913167 0.66 APP (0.52) SMN1; SMN2RAB9ANPC1ALDH1A1HPGD
SCHEMBL1993896 0.65 APP (0.42) SMN1; SMN2RAB9ANPC1NCOA1NCOA3
SCHEMBL1993895 0.65 APP (0.42) SMN1; SMN2RAB9ANPC1NCOA1NCOA3
SCHEMBL19789802 0.65 MAOB (0.47) SMN1; SMN2RAB9ANPC1ALDH1A1HPGD
SCHEMBL1069738 0.64 HPGDS (0.59) EGFRSMN1; SMN2POLBRAB9ANPC1
SCHEMBL621672 0.64 PDGFRB (0.58) EGFRHTTSMN1; SMN2POLBRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8883782-B2 Spiro-tetracyclic ring compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2014-11-11 US disclosed
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
EP-2547685-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA - SECRETASE MODULATORS Amgen Inc. (US) 2013-01-23 EP disclosed
US-20110251190-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2011-10-13 US disclosed
WO-2011115938-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA - SECRETASE MODULATORS AMGEN INC. (US) 2011-09-22 WO disclosed
EP-2328903-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETASECRETASE MODULATORS AND METHODS OF USE Amgen Inc. (US) 2011-06-08 EP 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 (2 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-20110251190-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE BACE1, BACE2, APP EGFR 2990/4885HTT 2520/4885SMN1; SMN2 2369/4885
US-20100087429-A1 SPIRO-TRICYCLIC RING COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE BACE1, BACE2, APP EGFR 3364/4885HTT 2516/4885SMN1; SMN2 2585/4885

“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.