SCHEMBL3963337

SCHEMBL3963337

CC(C(=O)O)c1nc2ccccc2s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.60
CYP1A2 P05177 2/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
HIF1A Q16665 1/20 0.60
HSD17B10 Q99714 1/20 0.60
ALOX5 P09917 1/20 0.58
LOXL2 Q9Y4K0 1/20 0.55
RAB9A P51151 5/20 0.53
TSHR P16473 2/20 0.51
ALOX15 P16050 1/20 0.51
CASP1 P29466 1/20 0.51
NPC1 O15118 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
ALDH1A1 P00352 2/20 0.49
AKR1B1 P15121 1/20 0.48
PKM P14618 2/20 0.48
GAA P10253 2/20 0.48
CASR P41180 1/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL11587666 0.85 ALOX5 (0.65) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL3060259 0.85 ALOX5 (0.57) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL11697365 0.83 HPGD (0.60) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL718297 0.83 HPGD (0.57) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL11165753 0.83 ALOX5 (0.62) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL3962528 0.83 RAB9A (0.56) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL11173254 0.81 ALOX5 (0.57) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL5536307 0.81 HPGD (0.66) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL5159135 0.80 HPGD (0.60) HPGDCYP1A2CYP2C9CYP2C19HIF1A
SCHEMBL11191161 0.80 HPGD (0.60) HPGDCYP1A2CYP2C9CYP2C19HIF1A

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-2081937-A2 TRIAZOLOPYRIDAZINE PROTEIN KINASE MODULATORS SGX Pharmaceuticals, Inc. (US) 2009-07-29 EP disclosed
US-20080287434-A1 New amino-alkyl-amide derivatives as CCR3 receptor ligands SANOFI-AVENTIS (FR) 2008-11-20 US disclosed
EP-1931620-A1 AMINO-ALKYL-AMIDE DERIVATIVES AS CCR3 RECEPTOR LIQUIDS Sanofi-Aventis (FR) 2008-06-18 EP disclosed
WO-2008051805-A2 TRIAZOLO-PYRIDAZINE PROTEIN KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-05-02 WO disclosed
WO-2007034252-A1 AMINO-ALKYL-AMIDE DERIVATIVES AS CCR3 RECEPTOR LIQUIDS SANOFI-AVENTIS (FR) 2007-03-29 WO disclosed
EP-0068563-A2 Heterocyclic acetic acid compounds and compositions for treating bone diseases THE PROCTER & GAMBLE COMPANY (US) 1983-01-05 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-20080287434-A1 New amino-alkyl-amide derivatives as CCR3 receptor ligands CCR3, CCR1, CCR4 HPGD 3574/4885CYP1A2 2460/4885CYP2C9 3319/4885

“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.