SCHEMBL19834040

SCHEMBL19834040

CN(C)c1ccccc1OB(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ORAI1 Q96D31 1/20 0.41
ORAI2 Q96SN7 1/20 0.41
ORAI3 Q9BRQ5 1/20 0.41
TRPV6 Q9H1D0 1/20 0.41
HTR6 P50406 3/20 0.38
ALDH1A1 P00352 3/20 0.34
MAPT P10636 3/20 0.34
GAA P10253 2/20 0.34
TSHR P16473 2/20 0.34
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TSPO P30536 1/20 0.34
LYPLA1 O75608 1/20 0.34
LYPLA2 O95372 1/20 0.34
KDM4E B2RXH2 2/20 0.33
MAPK1 P28482 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
MEN1 O00255 1/20 0.33
TRPM2 O94759 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL8830001 0.79 MAPT (0.39) ORAI1ORAI2ORAI3HTR6ALDH1A1
SCHEMBL8830005 0.76 MAPT (0.41) ORAI1ORAI2ORAI3HTR6ALDH1A1
SCHEMBL2458146 0.72 TSPO (0.46) HTR6ALDH1A1MAPTGAATSHR
SCHEMBL2539698 0.70 CA1 (0.57) ORAI1ORAI2ORAI3ALDH1A1MAPT
SCHEMBL11869356 0.69 TSPO (0.62) ALDH1A1GAATSHRTSPOMAPK1
SCHEMBL4181226 0.69 ALDH1A1 (0.46) ORAI1ORAI2ORAI3TRPV6HTR6
SCHEMBL2539697 0.69 MAPT (0.40) HTR6ALDH1A1MAPTGAATSHR
Hydrochloric Acid SCHEMBL2862732 0.69 CA1 (0.55) ORAI1ORAI2ORAI3ALDH1A1TSHR
SCHEMBL27509670 0.67 MAPT (0.39) HTR6ALDH1A1MAPTGAATSHR
Nitrogen SCHEMBL10985025 0.67 CA1 (0.52) ALDH1A1TSHRTP53MAPK1TDP1

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-10689403-B2 Method for preparing four-coordinated organic boron compound KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2020-06-23 US disclosed
US-20180298034-A1 Method for Preparing Four-Coordinated Organic Boron Compound KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2018-10-18 US disclosed
EP-3279204-A1 METHOD FOR PREPARING FOUR-COORDINATED ORGANIC BORON COMPOUND Korea Research Institute of Chemical Technology (KR) 2018-02-07 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 (2 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-10689403-B2 Method for preparing four-coordinated organic boron compound DBF4, OR10J3, BROX ORAI1 2168/4885ORAI2 628/4885ORAI3 347/4885
US-20180298034-A1 Method for Preparing Four-Coordinated Organic Boron Compound DBF4, OR10J3, BROX ORAI1 2168/4885ORAI2 628/4885ORAI3 347/4885

“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.