SCHEMBL6287782

SCHEMBL6287782

CC(C)(C)OC(=O)C(O)c1c[nH]c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
GPR84 Q9NQS5 3/20 0.46
FFAR1 O14842 2/20 0.46
ALDH1A1 P00352 1/20 0.46
GLA P06280 1/20 0.46
MAPK1 P28482 1/20 0.46
NOD2 Q9HC29 1/20 0.46
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
NR4A2 P43354 1/20 0.43
CREBBP Q92793 1/20 0.43
SLC22A6 Q4U2R8 1/20 0.43
MGAM O43451 2/20 0.43
GAA P10253 2/20 0.43
SI P14410 2/20 0.43
MGAM2 Q2M2H8 2/20 0.43
PKM P14618 2/20 0.43

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
SCHEMBL6287774 0.86 KMT2A (0.47) MAPTKMT2AMEN1GPR84FFAR1
SCHEMBL6987327 0.86 GPR84 (0.50) MAPTKMT2AMEN1GPR84FFAR1
SCHEMBL6287232 0.84 ALDH1A1 (0.55) MAPTKMT2AMEN1GPR84FFAR1
SCHEMBL6287075 0.81 KMT2A (0.58) MAPTKMT2AMEN1GPR84FFAR1
SCHEMBL6288442 0.80 KMT2A (0.48) MAPTKMT2AMEN1GPR84FFAR1
SCHEMBL4659399 0.78 HTR2A (0.43) MAPTKMT2AMEN1GPR84FFAR1
SCHEMBL27725523 0.78 MAPT (0.44) MAPTKMT2AMEN1GPR84FFAR1
SCHEMBL4659608 0.78 KMT2A (0.44) MAPTKMT2AMEN1GPR84FFAR1
SCHEMBL10014144 0.77 TACR1 (0.51) MAPTKMT2AMEN1NR4A2CREBBP
SCHEMBL719008 0.77 MAPT (0.57) MAPTKMT2AMEN1GPR84FFAR1

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
US-6911468-B2 Tyrosine phosphatase inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-06-28 US disclosed
US-20030144338-A1 Tyrosine phosphatase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-07-31 US disclosed
EP-1284260-A1 TYROSINE PHOSPHATASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-02-19 EP 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-20030144338-A1 Tyrosine phosphatase inhibitors PTPRC, PTPN1, PTPRM MAPT 4800/4885KMT2A 629/4885MEN1 2361/4885

“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.