SCHEMBL3753385

SCHEMBL3753385

O=Cc1ccc(-c2cccc(F)c2F)nc1Oc1ccccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.41
P2RY1 P47900 2/20 0.35
MPL P40238 1/20 0.35
IDO1 P14902 1/20 0.34
CD274 Q9NZQ7 4/20 0.33
MRGPRX1 Q96LB2 2/20 0.33
PDCD1LG2 Q9BQ51 2/20 0.33
AR P10275 1/20 0.33
ERN1 O75460 2/20 0.33
ACP1 P24666 1/20 0.33
CTSL P07711 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
PDCD1 Q15116 2/20 0.33
HTR1A P08908 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
CTSA P10619 1/20 0.32

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
SCHEMBL3751743 0.88 CD274 (0.37) CD274PDCD1LG2ERN1CTSLCTSS
SCHEMBL3747192 0.87 MPL (0.40) MPLCD274PDCD1LG2ERN1CTSL
SCHEMBL3753273 0.85 CTSA (0.37) CD274PDCD1LG2ERN1CTSLCTSS
SCHEMBL3754331 0.85 ERN1 (0.42) CD274PDCD1LG2ERN1PDCD1
SCHEMBL3749589 0.84 PDCD1LG2 (0.35) CD274PDCD1LG2ERN1CTSLCTSS
SCHEMBL3753274 0.83 PDE2A (0.39) MPLCD274PDCD1LG2
SCHEMBL3752299 0.82 ERN1 (0.36) CD274PDCD1LG2ERN1CTSLCTSS
SCHEMBL3752815 0.81 KMO (0.40) HSD11B1P2RY1IDO1CD274PDCD1
SCHEMBL3747206 0.80 ALK (0.38) HSD11B1
SCHEMBL3757999 0.79 PPARG (0.35) CD274PDCD1LG2ERN1CTSLCTSS

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 HSD11B1 1761/4885P2RY1 262/4885MPL 802/4885

“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.