SCHEMBL1783228

SCHEMBL1783228

[CH2]CCCNC(=O)c1ccc(C(=O)O)cn1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 2/20 0.53
P4HA1 P13674 1/20 0.53
MIF P14174 1/20 0.53
MAOB P27338 1/20 0.46
KDM4E B2RXH2 2/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 1/20 0.44
HIF1A Q16665 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
HCAR3 P49019 3/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43

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
SCHEMBL22269020 0.82 HCAR3 (0.59) P4HTMP4HA1MIFMAOBKDM4E
SCHEMBL841772 0.82 KCNH2 (0.57) P4HTMP4HA1MIFMAOBKDM4E
SCHEMBL841296 0.80 TSHR (0.59) P4HTMP4HA1MIFKDM4EALDH1A1
SCHEMBL2428778 0.79 HCAR3 (0.63) P4HTMP4HA1MIFMAOBKDM4E
SCHEMBL7269223 0.79 MAPK1 (0.56) NPC1ALDH1A1RAB9A
SCHEMBL841762 0.78 GRM5 (0.54) P4HTMP4HA1MIFNPC1RAB9A
SCHEMBL840824 0.78 P4HTM (0.51) P4HTMP4HA1MIFMAOBKDM4E
SCHEMBL9180148 0.76 P4HTM (0.66) P4HTMP4HA1MIFKDM4ENPC1
SCHEMBL4483140 0.75 P4HTM (0.47) P4HTMP4HA1MIFMAOBKDM4E
SCHEMBL1019074 0.75 L3MBTL1 (0.65) P4HTMP4HA1MIFKDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110117069-A1 METHOD FOR ACTIVATING REGULATORY T-CELLS IMTM GMBH (DE) 2011-05-19 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-20110117069-A1 METHOD FOR ACTIVATING REGULATORY T-CELLS ANPEP, DNPEP, RNPEP P4HTM 1057/4885P4HA1 1092/4885MIF 790/4885

“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.