SCHEMBL4009686

SCHEMBL4009686

O=S(=O)(c1ccc(B(O)O)cc1)N1CCC(F)(F)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.49
KMT2A Q03164 2/20 0.46
F13A1 P00488 1/20 0.45
TGM2 P21980 1/20 0.45
TGM1 P22735 1/20 0.45
ALDH1A1 P00352 4/20 0.45
MEN1 O00255 1/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PKM P14618 1/20 0.45
USP2 O75604 3/20 0.44
POLB P06746 3/20 0.44
TSHR P16473 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NAMPT P43490 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
ENPP2 Q13822 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL289460 0.82 USP2 (0.62) KMT2AALDH1A1MEN1PKMUSP2
SCHEMBL959386 0.82 USP2 (0.68) KMT2AALDH1A1MEN1PKMUSP2
SCHEMBL4008490 0.81 POLB (0.71) KMT2AALDH1A1MEN1MAPK1L3MBTL1
SCHEMBL1742543 0.80 USP2 (0.71) KMT2AALDH1A1MEN1L3MBTL1USP2
SCHEMBL14837469 0.80 PKM (0.64) KMT2AALDH1A1MEN1MAPK1L3MBTL1
SCHEMBL4002911 0.79 KMT2A (0.49) KMT2AALDH1A1MEN1L3MBTL1PKM
SCHEMBL4003126 0.79 USP2 (0.48) CYP2D6KMT2AF13A1TGM2TGM1
SCHEMBL16015073 0.79 GLA (0.51) ALDH1A1L3MBTL1USP2POLBTSHR
SCHEMBL477530 0.78 POLB (0.67) KMT2AALDH1A1MEN1MAPK1L3MBTL1
SCHEMBL144421 0.78 POLB (0.67) KMT2AALDH1A1MEN1MAPK1L3MBTL1

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-7494994-B2 Phenylpyridylpiperazine compounds LES LABORATOIRES SERVIER (FR) 2009-02-24 US disclosed
US-20060258670-A1 New phenylpyridylpiperazine compounds LES LABORATOIRES SERVIER (FR) 2006-11-16 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-20060258670-A1 New phenylpyridylpiperazine compounds HRH4, HRH3, HRH2 CYP2D6 1296/4885KMT2A 1578/4885F13A1 1447/4885

“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.