SCHEMBL8256758

SCHEMBL8256758

Fc1ccc2occ(I)c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.50
KDM4E B2RXH2 1/20 0.46
HTT P42858 1/20 0.46
GSK3B P49841 3/20 0.39
KMT2A Q03164 2/20 0.38
GLA P06280 1/20 0.38
GABRP O00591 2/20 0.36
GABRD O14764 2/20 0.36
GABRA1 P14867 2/20 0.36
GABRB1 P18505 2/20 0.36
GABRG2 P18507 2/20 0.36
GABRB3 P28472 2/20 0.36
GABRA5 P31644 2/20 0.36
GABRA3 P34903 2/20 0.36
GABRA2 P47869 2/20 0.36
GABRB2 P47870 2/20 0.36
GABRA4 P48169 2/20 0.36
GABRE P78334 2/20 0.36
GABRA6 Q16445 2/20 0.36
GABRG1 Q8N1C3 2/20 0.36

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
SCHEMBL27700648 0.85 PTPN1 (0.61) PTPN1KDM4EHTTGSK3BKMT2A
SCHEMBL84296 0.75 PTPN1 (0.50) PTPN1HTTGSK3BKMT2AMAOA
SCHEMBL12830182 0.75
SCHEMBL19099914 0.75 CYP3A4 (0.46) KMT2AMAOAMAOBMEN1
SCHEMBL31231895 0.75 PTPN1 (0.50) PTPN1KDM4EHTTGSK3BKMT2A
SCHEMBL23330765 0.75 PTPN1 (0.50) PTPN1KDM4EHTTGSK3BKMT2A
SCHEMBL2090321 0.75 PTPN1 (0.50) PTPN1KDM4EHTTGSK3BKMT2A
SCHEMBL718267 0.75 PTPN1 (0.50) PTPN1KDM4EHTTGSK3BKMT2A
SCHEMBL31231900 0.75 PTPN1 (0.50) PTPN1KDM4EHTTGSK3BKMT2A
SCHEMBL20274093 0.75 PTPN1 (0.50) PTPN1KDM4EHTTGSK3BKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050070578-A1 Small organic molecule regulators of cell proliferation CURIS, INC. 2005-03-31 US disclosed
US-20050070578-A1 Small organic molecule regulators of cell proliferation CURIS, INC. 2005-03-31 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 (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-20050070578-A1 Small organic molecule regulators of cell proliferation GLI1, SHH, SMO PTPN1 1696/4885KDM4E 732/4885HTT 2289/4885

“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.