SCHEMBL10967147

SCHEMBL10967147

O=C(O)C(=O)C1CCCCC1=O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.56
MAPK1 P28482 1/20 0.45
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 2/20 0.37
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP1A2 P05177 1/20 0.35
RECQL P46063 1/20 0.35
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL9547670 0.93 MCL1 (0.48) MCL1MAPK1CA1CA2CA4
SCHEMBL612494 0.82 MCL1 (0.60) MCL1MAPK1CA1CA2CA4
SCHEMBL3553694 0.82 MCL1 (0.60) MCL1MAPK1CA1CA2CA4
SCHEMBL8081259 0.80 MCL1 (0.58) MCL1MAPK1CA1CA2CA4
SCHEMBL28677273 0.80 MCL1 (0.58) MCL1MAPK1CA1CA2CA4
SCHEMBL7353241 0.80 MCL1 (0.58) MCL1MAPK1CA1CA2CA4
SCHEMBL17178416 0.80 MCL1 (0.58) MCL1MAPK1CA1CA2CA4
Ethane SCHEMBL4053553 0.78 MCL1 (0.56) MCL1MAPK1CA1CA2CA4
SCHEMBL10458616 0.77 MCL1 (0.55) MCL1MAPK1CA1CA2CA4
SCHEMBL16534456 0.77 MCL1 (0.55) MCL1MAPK1CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0028445-B1 ACRIDINONES, THEIR PREPARATION AND USE; INTERMEDIATES AND THEIR PREPARATION CIBA-GEIGY AG (CH) 1985-10-23 EP claimed
US-20190119193-A1 COMPOSITION FOR REGULATING PLANT GROWTH, METHOD FOR TREATING PLANTS THEREWITH, AND ACTIVE INGREDIENT THEREOF Ivan Aleksandrovich Starikov 2019-04-25 US disclosed
US-20190119193-A1 COMPOSITION FOR REGULATING PLANT GROWTH, METHOD FOR TREATING PLANTS THEREWITH, AND ACTIVE INGREDIENT THEREOF Ivan Aleksandrovich Starikov 2019-04-25 US disclosed
EP-0028445-B1 ACRIDINONES, THEIR PREPARATION AND USE; INTERMEDIATES AND THEIR PREPARATION CIBA-GEIGY AG (CH) 1985-10-23 EP disclosed
EP-0028445-A2 Acridinones, their preparation and use; intermediates and their preparation CIBA-GEIGY AG (CH) 1981-05-13 EP disclosed
US-4258190-A BY REACTING CYCLOHEXANONE AND AN OXALATE ESTER TO FORM A CYCLOHEXANONECARBOXYLATE INTERMEDIATE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-03-24 US disclosed
US-4256639-A Process for the synthesis of isatin derivatives AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO (IT) 1981-03-17 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-20190119193-A1 COMPOSITION FOR REGULATING PLANT GROWTH, METHOD FOR TREATING PLANTS THEREWITH, AND ACTIVE INGREDIENT THEREOF OGDH, GOT1, OAT MCL1 4772/4885MAPK1 1544/4885CA1 966/4885

“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.