SCHEMBL6287774

SCHEMBL6287774

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
GPR84 Q9NQS5 3/20 0.46
FFAR1 O14842 2/20 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
NOD2 Q9HC29 1/20 0.43
MGAM O43451 3/20 0.43
GAA P10253 3/20 0.43
SI P14410 3/20 0.43
MGAM2 Q2M2H8 3/20 0.43
PKM P14618 2/20 0.43
PBRM1 Q86U86 1/20 0.43
TACR1 P25103 2/20 0.43
TP53 P04637 1/20 0.42

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
SCHEMBL6287782 0.86 MAPT (0.47) KMT2AMAPTMEN1GPR84FFAR1
SCHEMBL6987327 0.86 GPR84 (0.50) KMT2AMAPTMEN1GPR84FFAR1
SCHEMBL6287227 0.84 NR4A2 (0.54) KMT2AMAPTMEN1GPR84FFAR1
SCHEMBL6287071 0.81 PKM (0.56) KMT2AMAPTMEN1GPR84FFAR1
SCHEMBL27725523 0.78 MAPT (0.44) KMT2AMAPTMEN1GPR84FFAR1
SCHEMBL4659399 0.78 HTR2A (0.43) KMT2AMAPTMEN1GPR84FFAR1
SCHEMBL4659608 0.78 KMT2A (0.44) KMT2AMAPTMEN1GPR84FFAR1
SCHEMBL6288442 0.77 KMT2A (0.48) KMT2AMAPTMEN1GPR84FFAR1
SCHEMBL6288440 0.77 MAPT (0.56) KMT2AMAPTMEN1HTR2AHTR2C
SCHEMBL6283244 0.77 GPR84 (0.59) KMT2AMAPTMEN1GPR84FFAR1

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 KMT2A 629/4885MAPT 4800/4885MEN1 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.