SCHEMBL23219881

SCHEMBL23219881

FB(c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.52
LMNA P02545 1/20 0.50
CYP2A6 P11509 1/20 0.50
ORAI1 Q96D31 1/20 0.44
ORAI2 Q96SN7 1/20 0.44
ORAI3 Q9BRQ5 1/20 0.44
TRPV6 Q9H1D0 1/20 0.44
IDO1 P14902 2/20 0.38
TSHR P16473 4/20 0.35
CYP1A2 P05177 1/20 0.35
MAPK1 P28482 3/20 0.33
CYP3A4 P08684 2/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALOX15 P16050 1/20 0.32
HIF1A Q16665 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL17236459 0.81 ENPP2 (0.52) ENPP2LMNACYP2A6ORAI1ORAI2
SCHEMBL1017379 0.73 ENPP2 (0.58) ENPP2LMNACYP2A6ORAI1ORAI2
SCHEMBL7673010 0.71 ENPP2 (0.55) ENPP2LMNACYP2A6ORAI1ORAI2
SCHEMBL17868174 0.71 ORAI1 (0.55) ORAI1ORAI2ORAI3TRPV6IDO1
1,4-Dichlorobenzene SCHEMBL11243685 0.71
1,4-Dichlorobenzene SCHEMBL5191 0.71
SCHEMBL28166 0.69 ENPP2 (1.00) ENPP2LMNACYP2A6ORAI1ORAI2
SCHEMBL1138482 0.69 TRPV6 (0.80) ENPP2LMNACYP2A6ORAI1ORAI2
SCHEMBL14309780 0.69 ENPP2 (0.52) ENPP2LMNACYP2A6ORAI1ORAI2
SCHEMBL1032443 0.67 TRPV6 (0.47) ENPP2LMNAORAI1ORAI2ORAI3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10973835-B2 Boron-containing small molecules for inhibiting activity of a receptor-like protein tyrosine phosphatase THE PENN STATE RESEARCH FOUNDATION (US) 2021-04-13 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-10973835-B2 Boron-containing small molecules for inhibiting activity of a receptor-like protein tyrosine phosphatase PTPRO, PTPRR, PPP1R1B ENPP2 404/4885LMNA 4860/4885CYP2A6 328/4885

“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.