SCHEMBL17036744

SCHEMBL17036744

CC(C)(C)Oc1cccc(OC(F)(F)F)c1F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MPL P40238 1/20 0.44
KCNH2 Q12809 1/20 0.38
PDE2A O00408 1/20 0.36
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
KCNK3 O14649 3/20 0.35
KCNK9 Q9NPC2 3/20 0.35
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HSD11B1 P28845 1/20 0.34
GRIA1 P42261 2/20 0.34
CACNG8 Q8WXS5 2/20 0.34
SCN9A Q15858 4/20 0.33
TRPA1 O75762 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 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
SCHEMBL17039548 0.83 KCNK3 (0.44) MPLKDM4EGAAKCNK3KCNK9
SCHEMBL13019837 0.81 SLC6A2 (0.43) KCNH2L3MBTL1TRPA1
SCHEMBL17037514 0.80 MPL (0.42) MPLPDE2AKDM4EKCNK3KCNK9
SCHEMBL6764211 0.80 IDO1 (0.37) MPLKCNH2HSD11B1
SCHEMBL900977 0.79 MPL (0.44) MPLKDM4EKCNK3KCNK9ALDH1A1
SCHEMBL18308923 0.79 KCNH2 (0.38) MPLKCNH2GAAALDH1A1TRPA1
SCHEMBL19240448 0.79 KCNK3 (0.49) MPLKCNK3KCNK9ALDH1A1
SCHEMBL28675923 0.79 ALDH1A1 (0.46) MPLALDH1A1L3MBTL1
SCHEMBL1401600 0.78 MPL (0.46) MPLKCNH2PDE2AKDM4EGRIA1
SCHEMBL1566030 0.78 KCNH2 (0.37) MPLKCNH2GAAHTR2AHTR2C

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 6 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-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-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 (4 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 MPL 121/4885KCNH2 3016/4885PDE2A 4490/4885
US-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH MPL 521/4885KCNH2 2608/4885PDE2A 1004/4885
US-20180022766-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS TFPI, CFD, C9 MPL 1390/4885KCNH2 2742/4885PDE2A 4711/4885
US-20150239920-A1 Ether Compounds for Treatment of Complement Mediated Disorders TFPI, CFD, C9 MPL 1390/4885KCNH2 2742/4885PDE2A 4711/4885

“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.