SCHEMBL5314641

SCHEMBL5314641

Nc1ccc2c(c1)C1(OCCO1)C(=O)N2

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.67
POLB P06746 3/20 0.53
GAA P10253 3/20 0.53
MEN1 O00255 2/20 0.53
MAPK1 P28482 1/20 0.53
ALDH1A1 P00352 2/20 0.45
CA9 Q16790 1/20 0.40
RPS6KA3 P51812 1/20 0.34
MAPT P10636 3/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C19 P33261 2/20 0.33
RET P07949 2/20 0.33
CYP3A4 P08684 1/20 0.33
EPHX2 P34913 1/20 0.33
TDP2 O95551 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PDPK1 O15530 1/20 0.32
FLT3 P36888 1/20 0.32
ALK Q9UM73 1/20 0.32
IDO1 P14902 1/20 0.31

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
SCHEMBL13196418 0.94 GAA (0.62) KMT2APOLBGAAMEN1MAPK1
SCHEMBL14389908 0.84 KMT2A (0.52) KMT2APOLBGAAMEN1MAPK1
SCHEMBL9097140 0.80 KMT2A (0.67) KMT2APOLBGAAMEN1MAPK1
SCHEMBL2154996 0.80 KMT2A (1.00) KMT2APOLBGAAMEN1MAPK1
SCHEMBL9097528 0.80 KMT2A (0.67) KMT2APOLBGAAMEN1MAPK1
SCHEMBL2780325 0.80 KMT2A (0.67) KMT2APOLBGAAMEN1MAPK1
SCHEMBL3469152 0.78 KMT2A (0.46) KMT2APOLBGAAMEN1MAPK1
SCHEMBL9098061 0.76 KMT2A (0.61) KMT2APOLBGAAMEN1MAPK1
SCHEMBL9053384 0.75 KMT2A (0.86) KMT2APOLBGAAMEN1MAPK1
SCHEMBL29963082 0.75 KMT2A (0.86) KMT2APOLBGAAMEN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220024900-A1 Compounds and Their Use for Reducing Uric Acid Levels ACQUIST LLC (US) 2022-01-27 US disclosed
US-11168075-B2 Compounds and their use for reducing uric acid levels ACQUIST LLC (US) 2021-11-09 US disclosed
US-20200347034-A1 Compounds and Their Use for Reducing Uric Acid Levels ACQUIST LLC (US) 2020-11-05 US disclosed
US-10759784-B2 Compounds and their use for reducing uric acid levels ACQUIST LLC (US) 2020-09-01 US disclosed
EP-1817310-A1 (SPIROCYCLYLAMIDO) AMINOTHIOPHENE COMPOUNDS AS C-KIT PROTO-ONCOGENE INHIBITORS OSI Pharmaceuticals, Inc. (US) 2007-08-15 EP disclosed
WO-2006034015-A1 (SPIROCYCLYLAMIDO) AMINOTHIOPHENE COMPOUNDS AS C-KIT PROTO- ONCOGENE INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2006-03-30 WO disclosed
US-20060063791-A1 (Spirocyclylamido)aminothiophene compounds OSI PHARMACEUTICALS, INC. 2006-03-23 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 (5 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-20200347034-A1 Compounds and Their Use for Reducing Uric Acid Levels XDH, OAT, PON1 KMT2A 3084/4885POLB 1934/4885GAA 336/4885
US-20220024900-A1 Compounds and Their Use for Reducing Uric Acid Levels XDH, OAT, PON1 KMT2A 3084/4885POLB 1934/4885GAA 336/4885
US-11168075-B2 Compounds and their use for reducing uric acid levels XDH, OAT, PON1 KMT2A 3084/4885POLB 1934/4885GAA 336/4885
US-20060063791-A1 (Spirocyclylamido)aminothiophene compounds KIT, BRDT, MALT1 KMT2A 267/4885POLB 4431/4885GAA 3044/4885
US-10759784-B2 Compounds and their use for reducing uric acid levels XDH, OAT, PON1 KMT2A 3084/4885POLB 1934/4885GAA 336/4885

“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.