SCHEMBL13316488

SCHEMBL13316488

COCCCN1C(=O)CCC1=O

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.55
HPGD P15428 2/20 0.55
HTT P42858 2/20 0.55
ALDH1A1 P00352 4/20 0.50
MAPT P10636 1/20 0.50
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 2/20 0.44
FAAH O00519 1/20 0.43
MGLL Q99685 1/20 0.43
CYP1A2 P05177 1/20 0.41
HTR1A P08908 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTR7 P34969 1/20 0.41
RECQL P46063 1/20 0.40
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL3629805 0.86 HTT (0.50) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL11806010 0.79 ALDH1A1 (0.55) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL18923349 0.78 POLB (0.48) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL888672 0.78 MEN1 (0.50) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL8829446 0.78 FAAH (0.53) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL6712978 0.77 DRD2 (0.43) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL32675956 0.76 MAPT (0.53) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL8829438 0.76 MGLL (0.52) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL1982535 0.76 MGLL (0.52) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL8629340 0.76 MGLL (0.52) SMN1; SMN2HPGDHTTALDH1A1MAPT

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-20100160311-A1 Fungicidal Azolopyrimidines, Process for Their Preparation and Their Use For Controlling Harmful Fungi, and Also Compositions Comprising Them BASF SE (DE) 2010-06-24 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 (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-20100160311-A1 Fungicidal Azolopyrimidines, Process for Their Preparation and Their Use For Controlling Harmful Fungi, and Also Compositions Comprising Them G6PD, CYP51A1, ERG28 SMN1; SMN2 4432/4885HPGD 1757/4885HTT 3388/4885

“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.