SCHEMBL6796887

SCHEMBL6796887

C=CCOP(=O)(OCC=C)OCc1ccccc1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.44
TP53 P04637 1/20 0.43
HTT P42858 1/20 0.43
PKM P14618 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 1/20 0.41
FOLH1 Q04609 3/20 0.41
LIG1 P18858 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
ALDH1A1 P00352 5/20 0.39
TSHR P16473 3/20 0.39
HSD17B10 Q99714 2/20 0.39
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.37
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
HPGD P15428 1/20 0.36
PDE3A Q14432 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL4683633 0.85 HSD17B10 (0.41) CYP3A4TP53HTTPKMSMN1; SMN2
SCHEMBL2751216 0.82 TSHR (0.51) TP53HTTKMT2AFOLH1MRGPRX4
SCHEMBL4680325 0.81 TSHR (0.36) CYP3A4HTTPKMSMN1; SMN2LIG1
SCHEMBL4683622 0.81 KEAP1 (0.38) CYP3A4PKMSMN1; SMN2LIG1ALDH1A1
SCHEMBL4681122 0.81 CSNK2A1 (0.39) CYP3A4PKMSMN1; SMN2KMT2ALIG1
SCHEMBL8791448 0.81 PKM (0.38) CYP3A4PKMSMN1; SMN2LIG1ALDH1A1
SCHEMBL22799778 0.80 CYP3A4 (0.50) CYP3A4TP53HTTKMT2AFOLH1
SCHEMBL4683685 0.80 SMN1; SMN2 (0.36) CYP3A4PKMSMN1; SMN2KMT2AALDH1A1
SCHEMBL9565658 0.79 PKM (0.36) CYP3A4PKMSMN1; SMN2LIG1ALDH1A1
SCHEMBL4683704 0.79 GAA (0.33) CYP3A4TP53PKMSMN1; SMN2TSHR

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-20040198790-A1 Water-soluble triazole fungicide SANKYO COMPANY, LIMITED (JP) 2004-10-07 US disclosed
EP-0558959-B1 Phosphonooxy and carbonate derivatives of taxol BRISTOL MYERS SQUIBB CO (US) 1997-04-16 EP disclosed
US-5272171-A Phosphonooxy and carbonate derivatives of taxol BRISTOL-MYERS SQUIBB COMPANY (US) 1993-12-21 US disclosed
EP-0569281-A1 Benzoate derivatives of taxol Bristol-Myers Squibb Company (US) 1993-11-10 EP disclosed
EP-0558959-A1 Phosphonooxy and carbonate derivatives of taxol Bristol-Myers Squibb Company (US) 1993-09-08 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-20040198790-A1 Water-soluble triazole fungicide ERG28, CYP51A1, XDH CYP3A4 87/4885TP53 1148/4885HTT 3703/4885

“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.