SCHEMBL279837

SCHEMBL279837

Cc1cccc(C(=O)NCC2CCCO2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 1.00
CYP2C9 P11712 2/20 0.73
CYP2C19 P33261 2/20 0.73
CYP1A2 P05177 1/20 0.73
GAA P10253 1/20 0.73
KDM4E B2RXH2 3/20 0.72
POLB P06746 2/20 0.72
HSD17B10 Q99714 2/20 0.72
SMN1; SMN2 Q16637 2/20 0.72
ALDH1A1 P00352 2/20 0.72
TP53 P04637 1/20 0.72
TSHR P16473 1/20 0.72
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68
RAB9A P51151 2/20 0.67
ATM Q13315 1/20 0.67
NPC1 O15118 1/20 0.65
CYP3A4 P08684 1/20 0.63
ALOX12 P18054 1/20 0.63
RECQL P46063 1/20 0.63

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
SCHEMBL26263553 0.96 HPGD (0.93) HPGDCYP2C9CYP2C19CYP1A2GAA
SCHEMBL11818229 0.87 HPGD (0.76) HPGDCYP2C9CYP2C19CYP1A2GAA
SCHEMBL12852623 0.85 ATM (0.75) HPGDCYP2C9CYP2C19CYP1A2GAA
SCHEMBL4763832 0.85 HPGD (0.73) HPGDCYP2C9CYP2C19CYP1A2GAA
SCHEMBL18176012 0.85 HPGD (0.73) HPGDCYP2C9CYP2C19CYP1A2GAA
SCHEMBL8736777 0.84 RAB9A (0.84) HPGDCYP2C9CYP2C19CYP1A2GAA
SCHEMBL279957 0.84 KMT2A (0.86) HPGDCYP2C9CYP2C19CYP1A2GAA
SCHEMBL11918653 0.84 KMT2A (0.86) HPGDCYP2C9CYP2C19CYP1A2GAA
SCHEMBL743611 0.84 HPGD (1.00) HPGDCYP2C9CYP2C19CYP1A2GAA
SCHEMBL30678539 0.84 HPGD (1.00) HPGDCYP2C9CYP2C19CYP1A2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8134013-B2 Amide compound and thrombopoietin receptor activator NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-03-13 US disclosed
US-8134013-B2 Amide compound and thrombopoietin receptor activator NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-03-13 US disclosed
US-20090131659-A1 AMIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-05-21 US disclosed
US-20090131659-A1 AMIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-05-21 US disclosed
EP-1845090-A1 AMIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR Nissan Chemical Industries, Ltd. (JP) 2007-10-17 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-20090131659-A1 AMIDE COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR TEK, PTAFR, MPL HPGD 1895/4885CYP2C9 3157/4885CYP2C19 2752/4885

“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.