SCHEMBL18587775

SCHEMBL18587775

O=C(c1ccc(F)c(B(O)O)c1)N1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
HPGD P15428 13/20 0.55
ALDH1A1 P00352 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
TSHR P16473 3/20 0.51
PLA2G7 Q13093 1/20 0.49
MLYCD O95822 1/20 0.49
POLB P06746 1/20 0.48
RECQL P46063 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
LMNA P02545 1/20 0.47

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
SCHEMBL29956836 1.00 MEN1 (0.56) MEN1KMT2AHPGDALDH1A1SMN1; SMN2
SCHEMBL29955262 0.98 HPGD (0.58) MEN1KMT2AHPGDALDH1A1SMN1; SMN2
SCHEMBL18587800 0.86 HPGD (0.57) MEN1KMT2AHPGDALDH1A1SMN1; SMN2
SCHEMBL29588971 0.86 HPGD (0.57) MEN1KMT2AHPGDALDH1A1SMN1; SMN2
SCHEMBL29953316 0.86 HPGD (0.58) MEN1KMT2AHPGDALDH1A1SMN1; SMN2
SCHEMBL2655426 0.83 KMT2A (0.73) MEN1KMT2AHPGDALDH1A1SMN1; SMN2
SCHEMBL24746292 0.82 HPGD (0.62) MEN1KMT2AHPGDALDH1A1SMN1; SMN2
SCHEMBL29944147 0.81 MEN1 (0.71) MEN1KMT2AHPGDALDH1A1SMN1; SMN2
SCHEMBL421902 0.80 KMT2A (0.73) MEN1KMT2AHPGDALDH1A1SMN1; SMN2
SCHEMBL13448531 0.79 MEN1 (0.55) MEN1KMT2AHPGDALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11352330-B2 Phenoxymethyl derivatives HOFFMANN-LA ROCHE INC. (US) 2022-06-07 US disclosed
US-20200339522-A1 PHENOXYMETHYL DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2020-10-29 US disclosed
EP-3344619-B1 PHENOXYMETHYL DERIVATIVES HOFFMANN LA ROCHE (CH) 2020-10-28 EP disclosed
US-10640472-B2 Phenoxymethyl derivatives HOFFMAN-LA ROCHE INC. (US) 2020-05-05 US disclosed
US-20180201588-A1 PHENOXYMETHYL DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2018-07-19 US disclosed
EP-3344619-A1 PHENOXYMETHYL DERIVATIVES H. Hoffnabb-La Roche Ag (CH) 2018-07-11 EP disclosed
WO-2017037146-A1 PHENOXYMETHYL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2017-03-09 WO 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 (4 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-20200339522-A1 PHENOXYMETHYL DERIVATIVES CNKSR1, RB1, RCOR1 MEN1 1981/4885KMT2A 530/4885HPGD 2706/4885
US-10640472-B2 Phenoxymethyl derivatives CNKSR1, RB1, RCOR1 MEN1 1981/4885KMT2A 530/4885HPGD 2706/4885
US-20180201588-A1 PHENOXYMETHYL DERIVATIVES CNKSR1, RB1, RCOR1 MEN1 1981/4885KMT2A 530/4885HPGD 2706/4885
US-11352330-B2 Phenoxymethyl derivatives CNKSR1, RB1, RCOR1 MEN1 1981/4885KMT2A 530/4885HPGD 2706/4885

“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.