SCHEMBL2610707

SCHEMBL2610707

COCOc1ccc(C=O)cc1F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.56
HPGD P15428 2/20 0.56
MEN1 O00255 1/20 0.56
POLB P06746 1/20 0.56
KMT2A Q03164 1/20 0.56
FDPS P14324 1/20 0.50
TSHR P16473 1/20 0.49
AOX1 Q06278 1/20 0.45
GAA P10253 1/20 0.43
TUBB1 Q9H4B7 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TRIM24 O15164 1/20 0.41
ALDH5A1 P51649 1/20 0.41
ABAT P80404 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TRIM33 Q9UPN9 1/20 0.41

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
SCHEMBL3926789 0.87 FDPS (0.50) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL3967524 0.85 FDPS (0.61) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL31160627 0.84 FDPS (0.64) ALDH1A1HPGDPOLBFDPSTSHR
SCHEMBL4255761 0.84 FDPS (0.64) ALDH1A1HPGDPOLBFDPSTSHR
SCHEMBL29888111 0.84 ALDH1A1 (0.51) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL2585951 0.83 ALDH1A1 (0.60) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL31054299 0.81 FDPS (0.75) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL2850023 0.81 FDPS (0.75) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL4702952 0.81 FDPS (0.51) ALDH1A1HPGDMEN1POLBKMT2A
SCHEMBL3394561 0.81 ALDH1A1 (0.70) ALDH1A1HPGDPOLBFDPSTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2626350-B1 CYCLOPROPANE COMPOUND EISAI R&D MAN CO LTD (JP) 2015-04-15 EP disclosed
EP-2626350-A1 CYCLOPROPANE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2013-08-14 EP disclosed
EP-2626350-A1 CYCLOPROPANE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2013-08-14 EP disclosed
US-8268848-B2 Cyclopropane compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-09-18 US disclosed
US-8268848-B2 Cyclopropane compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-09-18 US disclosed
US-8268848-B2 Cyclopropane compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-09-18 US disclosed
US-20120095031-A1 CYCLOPROPANE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-04-19 US disclosed
US-20120095031-A1 CYCLOPROPANE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-04-19 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-20120095031-A1 CYCLOPROPANE COMPOUND HCRTR1, HCRTR2, CNR1 ALDH1A1 2708/4885HPGD 2630/4885MEN1 2968/4885

“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.