SCHEMBL3759839

SCHEMBL3759839

Cc1cc(-c2ccc(C(=O)O)c(Oc3ccccc3Cl)n2)ccc1F

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.42
DHODH Q02127 1/20 0.41
ALDH1A1 P00352 3/20 0.40
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
CTSA P10619 1/20 0.40
KMO O15229 2/20 0.40
SRC P12931 1/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
PTGER4 P35408 1/20 0.39

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
SCHEMBL3745600 0.91 KMO (0.47) DHODHALDH1A1CTSAKMOMAPT
SCHEMBL13054024 0.90 ALDH1A1 (0.43) ALDH1A1KMOMAPTNPSR1PTGER4
SCHEMBL3755086 0.86 SMN1; SMN2 (0.46) DHODHALDH1A1MAPTNPSR1KDM4E
SCHEMBL3752101 0.85 SMN1; SMN2 (0.47) DHODHALDH1A1KMOMAPTNPSR1
SCHEMBL3752621 0.84 ALDH1A1 (0.54) ALDH1A1MAPTNPSR1KDM4EMEN1
SCHEMBL3753481 0.82 RORB (0.46) KMO
SCHEMBL3747547 0.81 MEN1 (0.40) DHODHALDH1A1CTSASRCMAPT
SCHEMBL3751995 0.80 SCN9A (0.44) ALDH1A1CTSAMAPTNPSR1KDM4E
SCHEMBL3762196 0.80 ALDH1A1 (0.41) ALDH1A1MAPTNPSR1MEN1HPGD
SCHEMBL3759594 0.80 RORB (0.48) DHODHALDH1A1KMOMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298221-A1 2-PHENOXY NICOTINE ACID DERIVATIVE AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-11-25 US disclosed
US-20100298221-A1 2-PHENOXY NICOTINE ACID DERIVATIVE AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-11-25 US disclosed
US-20100298221-A1 2-PHENOXY NICOTINE ACID DERIVATIVE AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-11-25 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-20100298221-A1 2-PHENOXY NICOTINE ACID DERIVATIVE AND USE THEREOF NAPRT, PNPO, FABP3 HPGDS 860/4885DHODH 1528/4885ALDH1A1 1855/4885

“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.