SCHEMBL19084604

SCHEMBL19084604

CC(C)(C)c1nn2c(=O)cc(-c3ccccc3C#N)[nH]c2c1-c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PSD A5PKW4 3/20 0.52
ARF6 P62330 8/20 0.45
CNR1 P21554 4/20 0.42
CNR2 P34972 4/20 0.42
PLAT P00750 1/20 0.39
KDM4E B2RXH2 2/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
PIM1 P11309 1/20 0.35
ATM Q13315 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL19084681 0.83 PSD (0.51) PSDARF6PLATKDM4EGLA
SCHEMBL19084690 0.80 PSD (0.49) PSDARF6PLATKDM4EALDH1A1
SCHEMBL19084515 0.78 PSD (0.49) PSDARF6PLATGAA
SCHEMBL19084662 0.76 ARF6 (0.58) PSDARF6PLAT
SCHEMBL19084663 0.76 PSD (0.52) PSDARF6
SCHEMBL19084516 0.76 PSD (0.51) PSDARF6CNR1PLAT
SCHEMBL19084615 0.75 PSD (0.52) PSDARF6PLAT
SCHEMBL17298733 0.75 ARF6 (0.63) PSDARF6PLATKDM4EGLA
SCHEMBL1278782 0.74 ARF6 (0.58) PSDARF6PLATKDM4E
SCHEMBL19084548 0.74 ARF6 (0.58) PSDARF6PLATALDH1A1KMT2A

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-10849901-B2 Arf6 inhibitors and methods of synthesis and use thereof NAVIGEN, INC. (US) 2020-12-01 US disclosed
US-20170189405-A1 ARF6 INHIBITORS AND METHODS OF SYNTHESIS AND USE THEREOF NAVIGEN, INC. (US) 2017-07-06 US disclosed
US-20170189405-A1 ARF6 INHIBITORS AND METHODS OF SYNTHESIS AND USE THEREOF NAVIGEN, INC. (US) 2017-07-06 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 (2 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-20170189405-A1 ARF6 INHIBITORS AND METHODS OF SYNTHESIS AND USE THEREOF ARF6, ARF1, ARFIP2 PSD 211/4885ARF6 1/4885CNR1 3560/4885
US-10849901-B2 Arf6 inhibitors and methods of synthesis and use thereof ARF6, ARF1, ARFIP2 PSD 211/4885ARF6 1/4885CNR1 3560/4885

“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.