SCHEMBL17039352

SCHEMBL17039352

COCCS(=O)(=O)N1CCN(C)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 3/20 0.40
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SMO Q99835 3/20 0.39
CNR2 P34972 2/20 0.37
CNR1 P21554 1/20 0.37
CYP3A4 P08684 1/20 0.36
POLB P06746 1/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 2/20 0.35
ATM Q13315 1/20 0.35
DHFR P00374 1/20 0.35
DRD2 P14416 1/20 0.34
HTR6 P50406 1/20 0.34

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
SCHEMBL12521990 0.89 MAPT (0.42) L3MBTL1MAPTUSP2SMN1; SMN2SMO
SCHEMBL17039437 0.83 MAPT (0.42) MAPTSMOCNR2CNR1CYP3A4
SCHEMBL17039355 0.82 TSHR (0.43) MAPTSMOPOLBALDH1A1
SCHEMBL17036749 0.79 L3MBTL1 (0.38) L3MBTL1MAPTUSP2SMN1; SMN2POLB
SCHEMBL25245730 0.78 MAPT (0.39) MAPTSMOCNR2CNR1CYP3A4
SCHEMBL3550366 0.78 MAPT (0.39) MAPTSMOCNR2CNR1CYP3A4
SCHEMBL17039356 0.78 ALDH1A1 (0.55) L3MBTL1MAPTUSP2SMN1; SMN2ALDH1A1
SCHEMBL13993544 0.77 MAPT (0.48) MAPTCNR2CNR1CYP3A4POLB
SCHEMBL10192197 0.77 L3MBTL1 (0.50) L3MBTL1MAPTUSP2SMN1; SMN2POLB
SCHEMBL24474544 0.76 MAPT (0.47) MAPTSMOCNR2CNR1CYP3A4

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 L3MBTL1 2183/4885MAPT 3995/4885USP2 4099/4885
US-20150239920-A1 Ether Compounds for Treatment of Complement Mediated Disorders TFPI, CFD, C9 L3MBTL1 942/4885MAPT 3823/4885USP2 4331/4885

“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.