SCHEMBL6286416

SCHEMBL6286416

CCCc1cc(C)n(-c2ccc(Br)cc2)c1-c1ccc(O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.42
MAPT P10636 5/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 3/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 2/20 0.41
ALOX15 P16050 2/20 0.41
GMNN O75496 1/20 0.41
USP2 O75604 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX12 P18054 1/20 0.41
NFKB1 P19838 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C19 P33261 1/20 0.41
THPO P40225 1/20 0.41

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
SCHEMBL6282845 0.85 KMT2A (0.41) MAPTKMT2AKDM4ELMNACYP1A2
SCHEMBL6286162 0.80 MAPT (0.43) ESR1MAPTKMT2AKDM4ETSHR
SCHEMBL6285673 0.75 ESR2 (0.42) ESR1MAPTKMT2AKDM4ETSHR
SCHEMBL6287858 0.71 MEN1 (0.70) MAPTKMT2AKDM4EHSD17B10ALOX15
SCHEMBL6287121 0.68 MEN1 (0.55) MAPTKMT2AKDM4EALOX15NPSR1
SCHEMBL6287200 0.67 MEN1 (0.53) MAPTKMT2AKDM4EALOX15NPSR1
SCHEMBL27637446 0.67 ESR1 (0.40) ESR1ESR2
SCHEMBL6279866 0.66 MEN1 (0.46) ESR1MAPTKMT2AKDM4ETSHR
SCHEMBL6279450 0.65 MEN1 (0.65) MAPTKMT2AKDM4EHSD17B10ALOX15
SCHEMBL5134545 0.65 MEN1 (0.61) ESR1MAPTKMT2AKDM4EALOX15

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 ESR1 3084/4885MAPT 4800/4885KMT2A 629/4885

“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.