SCHEMBL14555698

SCHEMBL14555698

CCOC(=O)Cn1nc2c(c1C(F)(F)F)C1CC1C2

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TRPM2 O94759 1/20 0.42
▸ PTGS2 P35354 1/20 0.40
▸ POLQ O75417 6/20 0.38
▸ MAPK1 P28482 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ CYP2C19 P33261 2/20 0.34
▸ CYP2C9 P11712 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ HTT P42858 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ SMN1; SMN2 Q16637 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
SCHEMBL14487510 0.84 PTGS2 (0.40) TRPM2PTGS2POLQMAPK1POLB
SCHEMBL23792578 0.80 MAPK1 (0.37) TRPM2PTGS2MAPK1POLBCYP2C19
SCHEMBL14487581 0.79 TRPM2 (0.42) TRPM2PTGS2MAPK1POLBCYP2C19
SCHEMBL31395465 0.79 TRPM2 (0.42) TRPM2PTGS2MAPK1POLBCYP2C19
SCHEMBL14487377 0.77 TRPM2 (0.40) TRPM2MAPK1POLBCYP2C19CYP2C9
SCHEMBL14484403 0.77 POLQ (0.58) TRPM2PTGS2POLQMAPK1POLB
SCHEMBL31648799 0.76 PTGS2 (0.41) TRPM2PTGS2POLQMAPK1POLB
SCHEMBL14488499 0.76 PTGS2 (0.43) TRPM2PTGS2POLQMAPK1POLB
SCHEMBL14484700 0.73 PTGS2 (0.43) TRPM2PTGS2POLQMAPK1POLB
SCHEMBL31395271 0.72 MAPK1 (0.36) TRPM2PTGS2MAPK1POLBCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2023-01-12 — — US disclosed
US-11034668-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2021-06-15 — — US disclosed
US-10370358-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2019-08-06 — — US disclosed
US-20180194746-A1 Compounds For the Treatment of HIV GILEAD SCIENCES, INC. 2018-07-12 — — US disclosed
US-20180194746-A1 Compounds For the Treatment of HIV GILEAD SCIENCES, INC. 2018-07-12 — — US disclosed
US-9944619-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2018-04-17 — — US disclosed
US-9944619-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2018-04-17 — — US disclosed
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2017-05-18 — — US disclosed
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2017-05-18 — — US disclosed
US-9540343-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2017-01-10 — — US disclosed
US-9540343-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2017-01-10 — — US disclosed
EP-2729448-B1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES INC (US) 2015-09-09 — — EP disclosed
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2014-05-22 — — US disclosed
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2014-05-22 — — US disclosed
WO-2013006738-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2013-01-10 — — WO 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-10370358-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN TRPM2 2456/4885PTGS2 2700/4885POLQ 1784/4885
US-20180194746-A1 Compounds For the Treatment of HIV CCR5, NPC1, FURIN TRPM2 2456/4885PTGS2 2700/4885POLQ 1784/4885
US-11034668-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN TRPM2 2456/4885PTGS2 2700/4885POLQ 1784/4885
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN TRPM2 2456/4885PTGS2 2700/4885POLQ 1784/4885
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN TRPM2 2456/4885PTGS2 2700/4885POLQ 1784/4885
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN TRPM2 2456/4885PTGS2 2700/4885POLQ 1784/4885

“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.

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