SCHEMBL2622478

SCHEMBL2622478

Cc1ccc(CCCCC(N)(CO)C(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 2/20 0.47
ARG2 P78540 2/20 0.47
TNNC1 P63316 5/20 0.44
S1PR1 P21453 4/20 0.44
S1PR4 O95977 3/20 0.44
S1PR3 Q99500 3/20 0.44
SGPL1 O95470 1/20 0.44
GPR183 P32249 1/20 0.44
CERS2 Q96G23 1/20 0.44
S1PR5 Q9H228 1/20 0.44
IGF1R P08069 1/20 0.41
ALOX15 P16050 1/20 0.41
GRM2 Q14416 1/20 0.41
GRM3 Q14832 1/20 0.41
SPHK2 Q9NRA0 3/20 0.40
S1PR2 O95136 2/20 0.39
PPARA Q07869 1/20 0.39
PLAAT3 P53816 1/20 0.39
PLAAT5 Q96KN8 1/20 0.39
PLAAT2 Q9NWW9 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
SCHEMBL2622475 0.89 S1PR1 (0.42) ARG1ARG2TNNC1S1PR1S1PR4
SCHEMBL14818917 0.86 ARG1 (0.49) ARG1ARG2TNNC1S1PR1S1PR4
SCHEMBL14145263 0.84 ALOX5 (0.47) ARG1ARG2IGF1RALOX15SPHK2
SCHEMBL13932736 0.81 S1PR1 (0.66) TNNC1S1PR1S1PR4S1PR3SGPL1
SCHEMBL13953044 0.79 ALOX5 (0.48) PPARA
SCHEMBL2632241 0.78 S1PR1 (0.61) TNNC1S1PR1S1PR4S1PR3SGPL1
SCHEMBL7616078 0.75 S1PR2 (0.44) S1PR1S1PR4S1PR3IGF1RALOX15
SCHEMBL14499316 0.74 GRM2 (0.50) ARG1ARG2S1PR1S1PR3GRM2
SCHEMBL13932769 0.73 S1PR1 (0.62) TNNC1S1PR1S1PR4S1PR3SGPL1
SCHEMBL13953244 0.71 ARG1 (0.36) ARG1ARG2

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 ARG1 2516/4885ARG2 251/4885TNNC1 2891/4885
US-20160346309-A1 TREATMENT OF VIRAL INFECTIONS BY MODULATION OF HOST CELL METABOLIC PATHWAYS GOT2, MAVS, ME3 ARG1 2516/4885ARG2 251/4885TNNC1 2891/4885
US-20130065850-A1 TREATMENT OF VIRAL INFECTIONS BY MODULATION OF HOST CELL METABOLIC PATHWAYS GOT2, MAVS, ME3 ARG1 2516/4885ARG2 251/4885TNNC1 2891/4885

“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.