SCHEMBL6429104

SCHEMBL6429104

CSC(C)CC(NC(c1ccccc1)c1ccccc1)[PH](=O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.33
CTSD P07339 1/20 0.33
MTOR P42345 1/20 0.33
RAB9A P51151 1/20 0.33
GRM7 Q14831 1/20 0.33
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
APAF1 O14727 1/20 0.32
TRPA1 O75762 2/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CTSL P07711 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
TEAD4 Q15561 1/20 0.32
MMP9 P14780 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
SCHEMBL3874438 0.74 EPHX1 (0.41) MTORRAB9AGRM7ALDH1A1MMP9
SCHEMBL9353502 0.74 POLB (0.44) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL1764563 0.73 TSHR (0.41) TSHRMEN1KMT2AMAPTMTOR
SCHEMBL6429935 0.68 EEF2K (0.36) MEN1KMT2ACTSDCYP3A4
SCHEMBL1764167 0.68 MTOR (0.39) TSHRKMT2ACTSDMTORRAB9A
SCHEMBL8584375 0.67 CYP2C19 (0.47) LMNAAPAF1
SCHEMBL25333708 0.63 LMNA (0.42) LMNAALDH1A1APAF1TRPA1MMP9
SCHEMBL23515628 0.63 ACP3 (0.50) TSHRMEN1KMT2ALMNAALDH1A1
SCHEMBL4889302 0.63 ADAMTS4 (0.49) TSHRMEN1KMT2AMAPTRAB9A
SCHEMBL4882907 0.63 ADAMTS4 (0.49) TSHRMEN1KMT2AMAPTRAB9A

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-20050107341-A1 Phosphinic acids F. HOFFMANN-LA ROCHE AG (CH) 2005-05-19 US claimed

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-20050107341-A1 Phosphinic acids BACE1, PSEN1, PSEN2 TSHR 3222/4885MEN1 550/4885KMT2A 2196/4885

“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.