SCHEMBL23423904

SCHEMBL23423904

CCCC[P@@](C)c1ccccc1Br

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.35
RECQL P46063 1/20 0.35
ALDH1A1 P00352 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CNR2 P34972 1/20 0.30
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30
F2R P25116 1/20 0.30

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
SCHEMBL7902844 0.86 KCNH2 (0.34) MEN1KMT2A
SCHEMBL7902228 0.86 KCNH2 (0.34) MEN1KMT2A
SCHEMBL7902229 0.86 KCNH2 (0.34) MEN1KMT2A
SCHEMBL7900732 0.78 KCNH2 (0.41) ALDH1A1MEN1KMT2ATSHR
SCHEMBL7900730 0.78 KCNH2 (0.41) ALDH1A1MEN1KMT2ATSHR
SCHEMBL7894780 0.78 KCNH2 (0.41) ALDH1A1MEN1KMT2ATSHR
SCHEMBL7904030 0.78 KCNH2 (0.41) ALDH1A1MEN1KMT2ATSHR
SCHEMBL7900733 0.78 KCNH2 (0.41) ALDH1A1MEN1KMT2ATSHR
SCHEMBL7894775 0.78 KCNH2 (0.41) ALDH1A1MEN1KMT2ATSHR
SCHEMBL22675923 0.74 SOAT1 (0.38) CNR2TSHR

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-20210155641-A1 METHOD FOR PRODUCING PHOSPHINOBENZENE BORANE DERIVATIVE, METHOD FOR PRODUCING 1,2-BIS(DIALKYLPHOSPHINO)BENZENE DERIVATIVE, AND TRANSITION METAL COMPLEX NIPPON CHEMICAL INDUSTRIAL CO., LTD. (JP) 2021-05-27 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-20210155641-A1 METHOD FOR PRODUCING PHOSPHINOBENZENE BORANE DERIVATIVE, METHOD FOR PRODUCING 1,2-BIS(DIALKYLPHOSPHINO)BENZENE DERIVATIVE, AND TRANSITION METAL COMPLEX P4HB, PAH, BOLA2; BOLA2B GRM2 618/4885RECQL 2847/4885ALDH1A1 1734/4885

“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.