SCHEMBL7561923

SCHEMBL7561923

C=C(CCOCc1cccc(OC)c1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CTBP2 P56545 1/20 0.49
MRGPRX4 Q96LA9 1/20 0.48
IDO1 P14902 2/20 0.48
AGXT P21549 2/20 0.48
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
MAOB P27338 2/20 0.44
MAOA P21397 1/20 0.44
MMP1 P03956 2/20 0.44
MMP2 P08253 2/20 0.44
MMP9 P14780 2/20 0.44
MMP12 P39900 2/20 0.44
GAA P10253 1/20 0.44
CHRM3 P20309 1/20 0.44

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
SCHEMBL6441998 0.83 MEN1 (0.54) MEN1KMT2ACTBP2KDM4EALDH1A1
SCHEMBL7557490 0.81 IDO1 (0.48) MEN1KMT2AMRGPRX4IDO1AGXT
SCHEMBL466108 0.81 SMN1; SMN2 (0.49) KMT2AALDH1A1
SCHEMBL1621499 0.81 HDAC1 (0.58) MEN1KMT2ACTBP2KDM4EALDH1A1
SCHEMBL7293162 0.80 CTBP2 (0.64) MEN1KMT2ACTBP2ALDH1A1CYP1A2
SCHEMBL1573160 0.78 SMN1; SMN2 (0.47) KMT2AALDH1A1
SCHEMBL2091873 0.78 IDO1 (0.61) IDO1AGXTMAOBCHRM3
SCHEMBL7557331 0.77 FFAR4 (0.51) MEN1KMT2AMRGPRX4IDO1KDM4E
SCHEMBL10048461 0.77 LMNA (0.61) MEN1KMT2ACTBP2MRGPRX4IDO1
SCHEMBL2970007 0.76 IDO1 (0.59) IDO1AGXTMAOBCHRM3

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-20020103381-A1 Method for the synthesis of pyrazolines CHEMRX ADVANCED TECHNOLOGIES, INC. 2002-08-01 US disclosed
WO-2001040193-A1 METHOD FOR THE SYNTHESIS OF PYRAZOLINES CHEMRX ADVANCED TECHNOLOGIES, INC. (US) 2001-06-07 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 (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-20020103381-A1 Method for the synthesis of pyrazolines CYP2F1, CYP2E1, CYP3A7 MEN1 253/4885KMT2A 3618/4885CTBP2 4085/4885

“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.