SCHEMBL2269230

SCHEMBL2269230

O=CNC(OCc1ccccc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 3/20 0.53
KMT2A Q03164 3/20 0.53
SLC1A3 P43003 2/20 0.53
SLC1A2 P43004 2/20 0.53
MEN1 O00255 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
EPHX1 P07099 1/20 0.47
TAAR1 Q96RJ0 1/20 0.45
FOLH1 Q04609 1/20 0.43
TSHR P16473 2/20 0.41
ALDH1A1 P00352 3/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40

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
SCHEMBL10721619 0.87 SLC1A1 (0.50) SLC1A1KMT2ASLC1A3SLC1A2MEN1
SCHEMBL10954741 0.83 SLC1A1 (0.45) SLC1A1KMT2ASLC1A3SLC1A2MEN1
SCHEMBL2648222 0.80 SLC1A1 (0.49) SLC1A1KMT2ASLC1A3SLC1A2MEN1
SCHEMBL7518962 0.80 SLC1A1 (0.56) SLC1A1KMT2ASLC1A3SLC1A2MEN1
SCHEMBL7440229 0.80 SLC1A1 (0.65) SLC1A1KMT2ASLC1A3SLC1A2MEN1
SCHEMBL8444795 0.79 PPID (0.42) SLC1A1KMT2ASLC1A3SLC1A2MEN1
SCHEMBL27857317 0.79 FOLH1 (0.58) SLC1A1KMT2ASLC1A3SLC1A2MEN1
SCHEMBL11635275 0.79 CNR2 (0.54) SLC1A1KMT2ASLC1A3SLC1A2MEN1
SCHEMBL5370668 0.78 SLC1A1 (0.50) SLC1A1KMT2ASLC1A3SLC1A2MEN1
SCHEMBL5370656 0.78 SLC1A1 (0.50) SLC1A1KMT2ASLC1A3SLC1A2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1724278-B1 NITROGENOUS FUSED-RING DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE DERIVATIVES, AND USE THEREOF AS DRUGS KISSEI PHARMACEUTICAL (JP) 2014-05-07 EP disclosed
US-7998975-B2 Sodium dependent glucose transporter inhibition; hyperglycemia associated diseases; 3-glucopyranosyloxy- 1H-indazole and 1H-pyrazolo[3,4-b]pyridine derivatives KISSEI PHARMACEUTICAL CO., LTD. (JP) 2011-08-16 US disclosed
US-20080188426-A1 NITROGENOUS FUSED-RING DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE DERIVATIVES, AND USE THEREOF AS DRUGS KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-08-07 US disclosed
US-7375113-B2 Nitrogenous fused-ring derivatives, medicinal compositions containing the derivatives, and use thereof as drugs KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-05-20 US disclosed
US-20070191289-A1 Nitrogenous fused-ring derivatives, medicinal compositions containing the derivatives, and use thereof as drugs KISSEI PHARMACEUTICAL CO., LTD. (JP) 2007-08-16 US disclosed
EP-1724278-A1 NITROGENOUS FUSED-RING DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE DERIVATIVES, AND USE THEREOF AS DRUGS Kissei Pharmaceutical Co., Ltd. (JP) 2006-11-22 EP 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 (2 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-20070191289-A1 Nitrogenous fused-ring derivatives, medicinal compositions containing the derivatives, and use thereof as drugs SLC5A1, SLC5A2, GPR119 SLC1A1 257/4885KMT2A 905/4885SLC1A3 271/4885
US-20080188426-A1 NITROGENOUS FUSED-RING DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE DERIVATIVES, AND USE THEREOF AS DRUGS SLC5A1, SLC5A2, SLC2A1 SLC1A1 274/4885KMT2A 699/4885SLC1A3 321/4885

“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.