SCHEMBL14714512

SCHEMBL14714512

O=C(NC(C(=O)O)C(=O)O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.66
NPC1 O15118 4/20 0.60
RAB9A P51151 4/20 0.60
CTDSP1 Q9GZU7 1/20 0.60
PTPN1 P18031 3/20 0.53
ALDH1A1 P00352 3/20 0.53
LMNA P02545 2/20 0.53
GAA P10253 1/20 0.53
ALOX12 P18054 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
CYP3A4 P08684 1/20 0.51
MAPT P10636 1/20 0.50
DEGS1 O15121 1/20 0.50
ROCK2 O75116 1/20 0.50
RPS6KA5 O75582 1/20 0.50

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
SCHEMBL5708283 0.88 SLC1A2 (0.58) HPGDSRAB9AALDH1A1LMNAGAA
SCHEMBL14714459 0.87 HPGDS (0.55) HPGDSNPC1RAB9ACTDSP1PTPN1
SCHEMBL14714631 0.84 HPGDS (0.60) HPGDSNPC1RAB9ACTDSP1PTPN1
SCHEMBL1750579 0.81 NPC1 (0.62) HPGDSNPC1RAB9ACTDSP1ALDH1A1
SCHEMBL6519640 0.81 NPC1 (0.62) HPGDSNPC1RAB9ACTDSP1ALDH1A1
SCHEMBL4652059 0.81 NPC1 (0.62) HPGDSNPC1RAB9ACTDSP1ALDH1A1
SCHEMBL4067128 0.81 ALDH1A1 (0.71) HPGDSNPC1RAB9ACTDSP1PTPN1
SCHEMBL12985717 0.80 CA2 (0.65) HPGDSNPC1RAB9ACTDSP1PTPN1
SCHEMBL10346696 0.80 CA2 (0.65) HPGDSNPC1RAB9ACTDSP1PTPN1
SCHEMBL4760256 0.79 DGAT1 (0.62) HPGDSNPC1RAB9ACTDSP1ALDH1A1

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
EP-2562155-B1 HYDROXAMIC ACID DERIVATIVE TAISHO PHARMACEUTICAL CO LTD (JP) 2019-06-05 EP disclosed
US-9073821-B2 Hydroxamic acid derivative TAISHO PHARMACEUTICAL CO., LTD (JP) 2015-07-07 US disclosed
US-20130072677-A1 NOVEL HYDROXAMIC ACID DERIVATIVE TOYAMA CHEMICAL CO., LTD. (JP) 2013-03-21 US disclosed
EP-2562155-A1 NOVEL HYDROXAMIC ACID DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2013-02-27 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 (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-20130072677-A1 NOVEL HYDROXAMIC ACID DERIVATIVE LCT, AGXT, HDAC9 HPGDS 166/4885NPC1 3272/4885RAB9A 2523/4885

“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.