SCHEMBL8279079

SCHEMBL8279079

CCCCCCCCCCCCCCNCC(O)CCCCCCCCCCC

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.49
ERAP2 Q6P179 1/20 0.49
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
GPR84 Q9NQS5 8/20 0.47
FFAR1 O14842 2/20 0.46
FFAR4 Q5NUL3 1/20 0.46
S1PR2 O95136 5/20 0.41
S1PR4 O95977 5/20 0.41
S1PR1 P21453 5/20 0.41
S1PR3 Q99500 5/20 0.41
S1PR5 Q9H228 1/20 0.41
FAAH O00519 1/20 0.41
SPHK1 Q9NYA1 1/20 0.41

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
SCHEMBL11528350 1.00 ANPEP (0.49) ANPEPERAP2ALDH1A1TSHRGPR84
SCHEMBL17199795 1.00 ANPEP (0.49) ANPEPERAP2ALDH1A1TSHRGPR84
SCHEMBL1270381 1.00 ANPEP (0.49) ANPEPERAP2ALDH1A1TSHRGPR84
SCHEMBL11522750 1.00 ANPEP (0.49) ANPEPERAP2ALDH1A1TSHRGPR84
SCHEMBL6118647 1.00 ANPEP (0.49) ANPEPERAP2ALDH1A1TSHRGPR84
SCHEMBL7320330 1.00 ANPEP (0.49) ANPEPERAP2ALDH1A1TSHRGPR84
SCHEMBL11677240 1.00 ANPEP (0.49) ANPEPERAP2ALDH1A1TSHRGPR84
SCHEMBL16859680 1.00 ANPEP (0.49) ANPEPERAP2ALDH1A1TSHRGPR84
SCHEMBL11523051 1.00 ANPEP (0.49) ANPEPERAP2ALDH1A1TSHRGPR84
SCHEMBL13833063 1.00 ANPEP (0.49) ANPEPERAP2ALDH1A1TSHRGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150183721-A1 AMINO-ALCOHOL ANALOGUES AND USES THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2015-07-02 US claimed
US-20150183721-A1 AMINO-ALCOHOL ANALOGUES AND USES THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2015-07-02 US disclosed
US-20150183721-A1 AMINO-ALCOHOL ANALOGUES AND USES THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2015-07-02 US disclosed
US-20150183721-A1 AMINO-ALCOHOL ANALOGUES AND USES THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2015-07-02 US disclosed
US-20120129947-A1 AMINO-ALCOHOL ANALOGUES AND USES THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM, LTD. (IL) 2012-05-24 US disclosed
US-20120129947-A1 AMINO-ALCOHOL ANALOGUES AND USES THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM, LTD. (IL) 2012-05-24 US disclosed
WO-2011016033-A1 AMINO-ALCOHOL ANALOGUES AND USES THEREOF YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM, LTD. (IL) 2011-02-10 WO 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-20150183721-A1 AMINO-ALCOHOL ANALOGUES AND USES THEREOF AADAT, ABAT, ADH1A ANPEP 206/4885ERAP2 718/4885ALDH1A1 73/4885
US-20120129947-A1 AMINO-ALCOHOL ANALOGUES AND USES THEREOF AADAT, ABAT, ADH1A ANPEP 206/4885ERAP2 718/4885ALDH1A1 73/4885

“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.