SCHEMBL2383287

SCHEMBL2383287

O=C(Nc1cccc(O)c1)C1CCCC1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.69
ALDH1A1 P00352 1/20 0.66
HPGD P15428 2/20 0.65
SMN1; SMN2 Q16637 2/20 0.64
KCNK3 O14649 1/20 0.62
KCNK9 Q9NPC2 1/20 0.62
LMNA P02545 2/20 0.61
MGLL Q99685 1/20 0.59
F2R P25116 1/20 0.58
GAA P10253 2/20 0.56
USP2 O75604 1/20 0.56
HTT P42858 1/20 0.56
PTPN1 P18031 1/20 0.56

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
SCHEMBL518401 0.93 GAA (0.64) NPSR1ALDH1A1HPGDSMN1; SMN2KCNK3
SCHEMBL28859905 0.91 ALDH1A1 (0.60) NPSR1ALDH1A1HPGDSMN1; SMN2KCNK3
SCHEMBL1720856 0.87 MGLL (0.56) NPSR1ALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL1242082 0.83 NPSR1 (0.69) NPSR1ALDH1A1HPGDSMN1; SMN2KCNK3
SCHEMBL4218895 0.82 ALDH1A1 (0.68) NPSR1ALDH1A1HPGDSMN1; SMN2KCNK3
SCHEMBL13920562 0.82 NPSR1 (1.00) NPSR1ALDH1A1HPGDSMN1; SMN2KCNK3
SCHEMBL20332958 0.82 ALDH1A1 (0.68) NPSR1ALDH1A1HPGDSMN1; SMN2KCNK3
SCHEMBL7814275 0.81 GRK2 (0.72) ALDH1A1SMN1; SMN2LMNAGAAHTT
SCHEMBL2151177 0.81 GRK2 (0.68) NPSR1ALDH1A1HPGDSMN1; SMN2KCNK3
SCHEMBL2246607 0.81 MEN1 (0.69) NPSR1ALDH1A1HPGDSMN1; SMN2KCNK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293715-B2 10a-Azalide compound crosslinked at 10a- and 12-positions TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-10-23 US disclosed
US-20110237784-A1 10A-AZALIDE COMPOUND CROSSLINKED AT 10A- AND 12-POSITIONS TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-09-29 US disclosed
EP-2177526-A1 10A-AZALIDE COMPOUND CROSSLINKED AT POSITION-10A AND POSITION-12 Taisho Pharmaceutical Co. Ltd. (JP) 2010-04-21 EP disclosed
US-5883106-A 5-lipoxygenase inhibitors PFIZER INC. (US) 1999-03-16 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-20110237784-A1 10A-AZALIDE COMPOUND CROSSLINKED AT 10A- AND 12-POSITIONS DCLRE1A, AZI2, CHD9 NPSR1 4165/4885ALDH1A1 2376/4885HPGD 109/4885

“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.