SCHEMBL5017658

SCHEMBL5017658

Nc1cc(F)ccc1NCCO

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 8/20 0.47
PRSS1 P07477 10/20 0.46
HDAC3 O15379 5/20 0.41
NCOR2 Q9Y618 2/20 0.40
HDAC2 Q92769 1/20 0.40
PTGER4 P35408 1/20 0.39
PIK3CA P42336 1/20 0.38

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
SCHEMBL8334585 0.89 PRSS1 (0.49) HDAC1PRSS1HDAC3NCOR2
SCHEMBL23963004 0.85 HDAC1 (0.50) HDAC1PRSS1HDAC3NCOR2HDAC2
SCHEMBL4054487 0.81 HDAC1 (0.44) HDAC1PRSS1HDAC3NCOR2HDAC2
SCHEMBL5225550 0.81 SHMT2 (0.44) PIK3CA
SCHEMBL2927441 0.81 PRSS1 (0.49) PRSS1PTGER4
SCHEMBL29126106 0.80 HDAC1 (0.51) HDAC1PRSS1HDAC3NCOR2HDAC2
SCHEMBL6571157 0.78 TDO2 (0.38) HDAC1PRSS1HDAC2
SCHEMBL7088249 0.78 SMN1; SMN2 (0.44) HDAC1PRSS1HDAC3
SCHEMBL18208607 0.78 KMT2A (0.44) PIK3CA
SCHEMBL10182367 0.78 PRSS1 (0.46) PRSS1PTGER4

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-7456293-B2 Substituted carboxylic acid derivatives for the treatment of diabetes and lipid disorders, their preparation and use SK HOLDING CO., LTD (KR) 2008-11-25 US disclosed
EP-1869004-A1 SUBSTITUTED CARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF DIABETES AND LIPID DISORDERS, THEIR PREPARATION AND USE SK Holdings Co., Ltd. (KR) 2007-12-26 EP disclosed
US-20060281802-A1 Substituted carboxylic acid derivatives for the treatment of diabetes and lipid disorders, their preparation and use SK BIOPHARMACEUTICALS CO., LTD. (KR) 2006-12-14 US disclosed
WO-2006104349-A1 SUBSTITUTED CARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF DIABETES AND LIPID DISORDERS, THEIR PREPARATION AND USE SK HOLDINGS CO., LTD. (KR) 2006-10-05 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-20060281802-A1 Substituted carboxylic acid derivatives for the treatment of diabetes and lipid disorders, their preparation and use SLC5A1, CPT1A, GPR119 HDAC1 995/4885PRSS1 2974/4885HDAC3 1447/4885

“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.