SCHEMBL6936734

SCHEMBL6936734

C=C1CCN(c2ccc(Cl)cc2)C1=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
HSD11B1 P28845 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
MGLL Q99685 1/20 0.38
CTSG P08311 1/20 0.38
CMA1 P23946 1/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL6937627 0.81 FAAH (0.38) MEN1KMT2AMGLLCTSGCMA1
SCHEMBL22728437 0.81 KMT2A (0.43) KMT2AMGLLPOLBNPC1RAB9A
SCHEMBL29420242 0.73 BCAT2 (0.65) HSD11B1MEN1KMT2ADRD2DRD3
SCHEMBL29163639 0.73 BCAT2 (0.65) HSD11B1MEN1KMT2ADRD2DRD3
SCHEMBL22330263 0.71 ALDH1A1 (0.47) DRD3L3MBTL1HPGD
SCHEMBL31318721 0.70 ALOX5 (0.43) ALOX5MEN1KMT2ACTSGCMA1
SCHEMBL9819245 0.70 CRBN (0.71) ALOX5HSD11B1MEN1KMT2ANPC1
SCHEMBL1703944 0.69 ALDH1A1 (0.62) ALOX5NPC1HPGDRAB9A
SCHEMBL29930316 0.69 ALDH1A1 (0.62) ALOX5NPC1HPGDRAB9A
SCHEMBL17699653 0.69 ALDH1A1 (0.49) ALOX5HSD11B1MEN1KMT2AMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030171578-A1 Pyrrolidinone derivative compound SCHERING AKTIENGESELLSCHAFT (DE) 2003-09-11 US disclosed
EP-0916656-B1 A method for production of pyrrolidinone derivatives SCHERING AG (DE) 2003-09-10 EP disclosed
US-6555694-B1 Reacting an aniline and cyclopropane-1,1-dicarboxylic acid; free of hydrogen-generating substance and moisture sensitive reagent; corrosion resistance; simplification; for piperazine derivatives used as central nervous system disorders SCHERING AKTIENGESELLSCHAFT (DE) 2003-04-29 US disclosed
US-6207825-B1 REACTING THE CORRESPONDING 3-CARBOXYPYRROLIDINONE COMPOUND IN THE PRESENCE OF FORMALDEHYDE MITSUI CHEMICALS, INC. (JP) 2001-03-27 US disclosed
EP-0916656-A2 A method for production of pyrrolidinone derivatives Mitsui Chemicals, Inc. (JP) 1999-05-19 EP 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-20030171578-A1 Pyrrolidinone derivative compound PFAS, CBR1, PYCR1 ALOX5 548/4885HSD11B1 20/4885MEN1 3594/4885

“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.