SCHEMBL10090449

SCHEMBL10090449

CN(CCO)C(=O)NCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.51
OPRL1 P41146 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.47
GAA P10253 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPT P10636 1/20 0.45
LMNA P02545 1/20 0.45
HPGD P15428 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
RIPK1 Q13546 1/20 0.45
HDAC1 Q13547 2/20 0.45
HDAC6 Q9UBN7 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL17346786 0.85 ALDH1A1 (0.53) OPRM1OPRL1SMN1; SMN2GAANPC1
SCHEMBL23686835 0.83 NPC1 (0.62) OPRM1OPRL1NPC1RAB9AMEN1
SCHEMBL17342631 0.83 ALDH1A1 (0.50) OPRM1OPRL1SMN1; SMN2GAAALDH1A1
SCHEMBL10090330 0.83 HDAC1 (0.55) OPRM1OPRL1NPC1ALDH1A1KMT2A
SCHEMBL1134867 0.80 TSHR (0.60) OPRM1OPRL1SMN1; SMN2GAAALDH1A1
SCHEMBL11611701 0.80 OPRM1 (0.58) OPRM1OPRL1SMN1; SMN2GAAALDH1A1
SCHEMBL22135044 0.80 L3MBTL1 (0.55) OPRM1OPRL1SMN1; SMN2GAAALDH1A1
SCHEMBL10090413 0.80 KMT2A (0.57) SMN1; SMN2GAAALDH1A1MEN1KMT2A
SCHEMBL17342633 0.79 ALDH1A1 (0.46) OPRM1OPRL1SMN1; SMN2GAAALDH1A1
SCHEMBL7749629 0.79 OPRM1 (0.50) OPRM1OPRL1SMN1; SMN2GAANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148541-B2 Rhodanine derivatives, a process for the preparation thereof and pharmaceutical composition containing the same KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2012-04-03 US disclosed
US-20090042872-A1 Rhodanine Derivatives, a Process for the Preparation Thereof and Pharmaceutical Composition Containing the Same KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2009-02-12 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-20090042872-A1 Rhodanine Derivatives, a Process for the Preparation Thereof and Pharmaceutical Composition Containing the Same PTPRR, PTPRG, PTPRS OPRM1 4408/4885OPRL1 3335/4885SMN1; SMN2 4461/4885

“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.