SCHEMBL6287858

SCHEMBL6287858

CCCc1ccc(-c2ccc(O)cc2)n1-c1ccc(Br)cc1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.70
KMT2A Q03164 5/20 0.70
MAPT P10636 11/20 0.55
KDM4E B2RXH2 4/20 0.55
POLB P06746 3/20 0.53
ALDH1A1 P00352 4/20 0.52
MYC P01106 1/20 0.48
HTT P42858 1/20 0.43
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TP53 P04637 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL6279450 0.88 MEN1 (0.65) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL6282767 0.83 MAPT (0.59) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL1905909 0.82 MEN1 (0.65) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL1903643 0.82 MEN1 (1.00) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL1900966 0.81 MEN1 (0.71) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL1903075 0.81 MEN1 (0.79) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL5134545 0.81 MEN1 (0.61) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL3253053 0.79 MEN1 (0.61) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL1901745 0.79 MEN1 (0.76) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL1905681 0.78 MEN1 (0.60) MEN1KMT2AMAPTKDM4EPOLB

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 MEN1 2361/4885KMT2A 629/4885MAPT 4800/4885

“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.