SCHEMBL17036719

SCHEMBL17036719

CC(C)(C)OCCS(=O)(=O)N1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.36
HPGD P15428 1/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 3/20 0.34
GAA P10253 2/20 0.34
NPBWR1 P48145 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.33
RECQL P46063 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL17036734 0.98 ALDH1A1 (0.34) TSHRHPGDCA1CA2POLB
SCHEMBL17036749 0.84 L3MBTL1 (0.38) TSHRPOLBKMT2AALDH1A1MAPK1
SCHEMBL12452723 0.83 TSHR (0.33) TSHRHPGDCA1CA2POLB
SCHEMBL17036741 0.82 ALDH1A1 (0.51) TSHRKMT2AALDH1A1LMNAL3MBTL1
SCHEMBL17039355 0.79 TSHR (0.43) TSHRHPGDCA1CA2POLB
SCHEMBL17039437 0.76 MAPT (0.42) TSHRHPGDALDH1A1LMNAKDM4E
SCHEMBL18572507 0.76 TSHR (0.33) TSHRHPGDCA1CA2POLB
SCHEMBL17039349 0.73 ALDH1A1 (0.44) TSHRHPGDCA1CA2KMT2A
SCHEMBL17052450 0.73 CNR1 (0.38) HPGDKMT2AALDH1A1GAALMNA
SCHEMBL19804012 0.72 ALDH1A1 (0.44) TSHRHPGDCA1CA2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-03-09 US disclosed
US-10550140-B2 Ether compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2020-02-04 US disclosed
US-20190048033-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2019-02-14 US disclosed
US-20180022766-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2018-01-25 US disclosed
US-20180022766-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2018-01-25 US disclosed
US-9732104-B2 Ether compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
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 (6 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-10550140-B2 Ether compounds for treatment of complement mediated disorders TFPI, CFD, C9 TSHR 1591/4885HPGD 3029/4885CA1 3111/4885
US-20160362433-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS CFD, C9, TFPI TSHR 1898/4885HPGD 2054/4885CA1 4833/4885
US-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH TSHR 3263/4885HPGD 92/4885CA1 3777/4885
US-20190048033-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS TFPI, CFD, C9 TSHR 1591/4885HPGD 3029/4885CA1 3111/4885
US-20180022766-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS TFPI, CFD, C9 TSHR 1591/4885HPGD 3029/4885CA1 3111/4885
US-20150239920-A1 Ether Compounds for Treatment of Complement Mediated Disorders TFPI, CFD, C9 TSHR 1591/4885HPGD 3029/4885CA1 3111/4885

“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.