SCHEMBL16038474

SCHEMBL16038474

O=C(Oc1ccc(Cl)cc1O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.51
MAPT P10636 4/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
MEN1 O00255 3/20 0.51
ESR1 P03372 2/20 0.51
ESR2 Q92731 2/20 0.51
USP2 O75604 2/20 0.51
ALOX15 P16050 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
HSD17B10 Q99714 2/20 0.51
GAA P10253 2/20 0.51
JAK2 O60674 1/20 0.51
SERPINE1 P05121 1/20 0.49
TTR P02766 2/20 0.48
LMNA P02545 3/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
NR1I2 O75469 2/20 0.47
TP53 P04637 2/20 0.47
AHR P35869 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
SCHEMBL16039283 0.87 KMT2A (0.51) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL16038480 0.86 KMT2A (0.53) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL8207859 0.85 MRGPRX4 (0.55) KMT2AMAPTSMN1; SMN2MEN1TTR
SCHEMBL9743098 0.83 ESR1 (0.66) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL8204812 0.82 KMT2A (0.54) KMT2AMAPTSMN1; SMN2MEN1LMNA
SCHEMBL27727216 0.82 CYP1A2 (0.54) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL28337798 0.81 KMT2A (0.60) KMT2AMAPTMEN1TTRLMNA
SCHEMBL5693506 0.80 TTR (0.53) MAPTHSD17B10TTRLMNANR1I2
SCHEMBL28663041 0.80 KMT2A (0.52) KMT2AMAPTSMN1; SMN2MEN1ESR1
SCHEMBL11089698 0.79 KMT2A (0.60) KMT2AMAPTSMN1; SMN2MEN1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014140220-A1 PROCESS FOR THE PREPARATION OF (2,3-DIHYDRO-BENZO[B][1,4]DIOXIN-2-YL) METHANOL DERIVATIVES JANSSEN PHARMACEUTICA, N.V. (BE) 2014-09-18 WO disclosed
WO-2014140220-A1 PROCESS FOR THE PREPARATION OF (2,3-DIHYDRO-BENZO[B][1,4]DIOXIN-2-YL) METHANOL DERIVATIVES JANSSEN PHARMACEUTICA, N.V. (BE) 2014-09-18 WO disclosed
US-20140275576-A1 PROCESS FOR THE PREPARATION OF (2,3-DIHYDRO-BENZO[B][1,4]DIOXIN-2-YL) METHANOL DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2014-09-18 US disclosed
US-20140275576-A1 PROCESS FOR THE PREPARATION OF (2,3-DIHYDRO-BENZO[B][1,4]DIOXIN-2-YL) METHANOL DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2014-09-18 US disclosed
US-20140275576-A1 PROCESS FOR THE PREPARATION OF (2,3-DIHYDRO-BENZO[B][1,4]DIOXIN-2-YL) METHANOL DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2014-09-18 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-20140275576-A1 PROCESS FOR THE PREPARATION OF (2,3-DIHYDRO-BENZO[B][1,4]DIOXIN-2-YL) METHANOL DERIVATIVES CYP1B1, CYP1A1, CYP4B1 KMT2A 1117/4885MAPT 3962/4885SMN1; SMN2 1767/4885

“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.