SCHEMBL17039331

SCHEMBL17039331

CCOP(=O)(COC)CC1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.42
MMP2 P08253 2/20 0.42
NPSR1 Q6W5P4 1/20 0.35
EPHX2 P34913 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MMP3 P08254 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
CA9 Q16790 1/20 0.32
TSHR P16473 1/20 0.31
METAP1 P53582 1/20 0.31
CYP1A2 P05177 1/20 0.31
LMNA P02545 1/20 0.30
EPHX1 P07099 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL17039329 0.98 MMP1 (0.40) MMP1MMP2NPSR1EPHX2SMN1; SMN2
SCHEMBL17039370 0.95 MMP1 (0.36) MMP1MMP2TSHRTDP1
SCHEMBL18311508 0.86 MMP1 (0.39) MMP1MMP2TSHRCYP1A2ACHE
SCHEMBL19240602 0.84 MMP1 (0.36) MMP1MMP2TSHRTDP1
SCHEMBL17036737 0.82 MMP1 (0.36) MMP1MMP2
SCHEMBL19803983 0.82 MMP1 (0.36) MMP1MMP2CYP1A2
SCHEMBL17036747 0.80 MMP1 (0.34) MMP1MMP2
SCHEMBL17759351 0.79 MMP1 (0.37) MMP1MMP2TSHRTDP1
SCHEMBL17036727 0.77 MMP1 (0.31) MMP1MMP2
SCHEMBL7915207 0.77 PPARD (0.44) MMP1MMP2CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9732104-B2 Ether compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
US-20160362433-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2016-12-15 US disclosed
US-20150239920-A1 Ether Compounds for Treatment of Complement Mediated Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2015-08-27 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 (2 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-20160362433-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS CFD, C9, TFPI MMP1 4217/4885MMP2 2940/4885NPSR1 3938/4885
US-20150239920-A1 Ether Compounds for Treatment of Complement Mediated Disorders TFPI, CFD, C9 MMP1 4144/4885MMP2 2811/4885NPSR1 3897/4885

“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.