SCHEMBL3273673

SCHEMBL3273673

COc1cccc2c1C(=O)O2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
MEN1 O00255 5/20 0.50
POLB P06746 2/20 0.50
TOP1 P11387 1/20 0.48
ALDH1A1 P00352 6/20 0.46
KDM4E B2RXH2 5/20 0.46
HPGD P15428 4/20 0.46
HSD17B10 Q99714 1/20 0.46
MAPT P10636 6/20 0.45
RAB9A P51151 4/20 0.45
NPC1 O15118 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
ODC1 P11926 1/20 0.44

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
SCHEMBL8447679 0.86 MEN1 (0.46) KMT2AMEN1POLBTOP1ALDH1A1
SCHEMBL9343381 0.83 TYMS (0.38) KMT2AMEN1POLBTOP1ALDH1A1
SCHEMBL8996379 0.78 KDM4E (0.56) KMT2AMEN1POLBTOP1ALDH1A1
SCHEMBL382674 0.78 TOP1 (0.56) KMT2AMEN1POLBTOP1ALDH1A1
SCHEMBL30610021 0.78 TOP1 (0.56) KMT2AMEN1POLBTOP1ALDH1A1
SCHEMBL16317537 0.76 NR3C1 (0.49) KMT2AMEN1POLBTOP1ALDH1A1
SCHEMBL23655043 0.76 ALDH1A1 (0.48) KMT2AMEN1TOP1ALDH1A1KDM4E
SCHEMBL28148154 0.74 CA1 (0.65) KMT2AMEN1TOP1ALDH1A1KDM4E
SCHEMBL1922596 0.73 KDM4E (0.55) KMT2AMEN1TOP1ALDH1A1KDM4E
SCHEMBL7604955 0.73 CA9 (0.43) KMT2AMEN1POLBTOP1ALDH1A1

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
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-20100087429-A1 SPIRO-TRICYCLIC RING COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2010-04-08 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 (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 KMT2A 3308/4885MEN1 4037/4885POLB 3305/4885

“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.