SCHEMBL3432880

SCHEMBL3432880

O=C(Nc1ccc2c(c1)OCO2)c1nn(CCOc2ccc(F)cc2)c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.51
TSHR P16473 4/20 0.51
USP2 O75604 4/20 0.51
NPY1R P25929 1/20 0.51
NPY2R P49146 1/20 0.51
RAB9A P51151 7/20 0.50
NPSR1 Q6W5P4 3/20 0.50
MEN1 O00255 2/20 0.50
ELANE P08246 1/20 0.50
ATM Q13315 1/20 0.50
MAPT P10636 5/20 0.49
NPC1 O15118 5/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 2/20 0.49
HTT P42858 2/20 0.49
GAA P10253 1/20 0.49
ALDH1A1 P00352 2/20 0.45
ESR1 P03372 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45

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
SCHEMBL3428314 0.93 TSHR (0.55) KMT2ATSHRUSP2NPY1RNPY2R
SCHEMBL3427834 0.89 TSHR (0.55) KMT2ATSHRUSP2NPY1RNPY2R
SCHEMBL3430571 0.80 ELANE (0.47) KMT2ARAB9AMEN1ELANEMAPT
SCHEMBL3431593 0.80 NPC1 (0.49) KMT2ATSHRRAB9AMEN1ELANE
SCHEMBL3429942 0.79 TSHR (0.57) KMT2ATSHRUSP2NPY1RNPY2R
SCHEMBL3406432 0.79 RAB9A (0.61) KMT2ATSHRUSP2NPY1RNPY2R
SCHEMBL3428867 0.78 PTGER4 (0.46) KMT2AUSP2RAB9AMEN1ELANE
SCHEMBL3428420 0.77 TSHR (0.53) KMT2ATSHRUSP2NPY1RNPY2R
SCHEMBL3430299 0.77 USP2 (0.55) KMT2ATSHRUSP2NPY1RNPY2R
SCHEMBL3432576 0.76 ELANE (0.54) KMT2ARAB9AMEN1ELANEMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2257340-A2 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BioMarin IGA Limited (BS) 2010-12-08 EP claimed
US-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 US claimed
WO-2009121623-A2 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2009-10-08 WO claimed
EP-2257340-A2 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BioMarin IGA Limited (BS) 2010-12-08 EP disclosed
US-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 US disclosed
US-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 US disclosed
US-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 US disclosed
WO-2009121623-A2 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2009-10-08 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 (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-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY CPT1B, SMN1; SMN2, GYS1 KMT2A 2516/4885TSHR 2079/4885USP2 2684/4885

“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.