SCHEMBL2622471

SCHEMBL2622471

CCC(C)(C)CCCCC(=O)OCCCCC(C)(C)CO

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DGKA P23743 1/20 0.44
▸ PRSS1 P07477 1/20 0.40
▸ PRSS2 P07478 1/20 0.40
▸ PRSS3 P35030 1/20 0.40
▸ DNM1 Q05193 1/20 0.38
▸ TLR2 O60603 1/20 0.38
▸ HTR2C P28335 1/20 0.37
▸ NAAA Q02083 1/20 0.37
▸ CNR2 P34972 1/20 0.37
▸ EPHX2 P34913 1/20 0.36
▸ PAM P19021 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ DUSP3 P51452 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 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
SCHEMBL6465156 0.93 DGKA (0.46) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL6465803 0.92 DGKA (0.48) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL21226023 0.86 DGKA (0.47) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL16254536 0.83 DGKA (0.45) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL20512071 0.83 DGKA (0.48) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL14344628 0.83 NAAA (0.44) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL28718240 0.82 DGKA (0.59) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL14048718 0.81 NAAA (0.47) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL14565821 0.80 DGKA (0.46) DGKAPRSS1PRSS2PRSS3DNM1
SCHEMBL19861337 0.80 CYP1A2 (0.50) DGKAPAMKMT2A

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
US-9757407-B2 Treatment of viral infections by modulation of host cell metabolic pathways THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2017-09-12 — — US disclosed
US-20160346309-A1 TREATMENT OF VIRAL INFECTIONS BY MODULATION OF HOST CELL METABOLIC PATHWAYS UNIV PRINCETON (US) 2016-12-01 — — US disclosed
US-9029413-B2 Treatment of viral infections by modulation of host cell metabolic pathways THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2015-05-12 — — US disclosed
US-20130065850-A1 TREATMENT OF VIRAL INFECTIONS BY MODULATION OF HOST CELL METABOLIC PATHWAYS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2013-03-14 — — US disclosed
US-8158677-B2 Treatment of viral infections by modulation of host cell metabolic pathways THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2012-04-17 — — US disclosed
US-20090239830-A1 Treatment of viral infections by modulation of host cell metabolic pathways KADMON CORPORATION, LLC 2009-09-24 — — 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 (3 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-20090239830-A1 Treatment of viral infections by modulation of host cell metabolic pathways GOT2, MAVS, ME3 DGKA 2037/4885PRSS1 716/4885PRSS2 1112/4885
US-20160346309-A1 TREATMENT OF VIRAL INFECTIONS BY MODULATION OF HOST CELL METABOLIC PATHWAYS GOT2, MAVS, ME3 DGKA 2037/4885PRSS1 716/4885PRSS2 1112/4885
US-20130065850-A1 TREATMENT OF VIRAL INFECTIONS BY MODULATION OF HOST CELL METABOLIC PATHWAYS GOT2, MAVS, ME3 DGKA 2037/4885PRSS1 716/4885PRSS2 1112/4885

“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.

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