SCHEMBL17332154

SCHEMBL17332154

CC(C)COC(=O)c1ccc2c(c1)COc1cc3c(cc1-2)CCCC3=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 2/20 0.37
▸ ADRB1 P08588 2/20 0.37
▸ ADRB3 P13945 2/20 0.37
▸ PLA2G1B P04054 1/20 0.36
▸ ATG4B Q9Y4P1 1/20 0.36
▸ PRF1 P14222 1/20 0.36
▸ GAPDH P04406 1/20 0.36
▸ HSPA1A P0DMV8 1/20 0.36
▸ PTPN7 P35236 1/20 0.36
▸ AAK1 Q2M2I8 2/20 0.35
▸ ROCK2 O75116 6/20 0.35
▸ BAZ2B Q9UIF8 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ TAS1R3 Q7RTX0 1/20 0.34
▸ TAS1R1 Q7RTX1 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ PRKCI P41743 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
SCHEMBL17332111 0.89 PRF1 (0.46) ADRB2PRF1BAZ2BALDH1A1MAPK1
SCHEMBL17332107 0.87 LMNA (0.40) PRF1ROCK2BAZ2BALDH1A1MAPK1
SCHEMBL17332112 0.87 BAZ2B (0.36) PRF1ROCK2BAZ2BALDH1A1MAPK1
SCHEMBL17332124 0.87 SRD5A1 (0.41) ROCK2BAZ2BALDH1A1MAOAMAOB
SCHEMBL17332076 0.85 ROCK2 (0.44) ROCK2BAZ2BALDH1A1MAPK1MAOA
SCHEMBL17332073 0.85 ALDH1A1 (0.42) PRF1GAPDHHSPA1APTPN7ALDH1A1
SCHEMBL17332151 0.84 MAOA (0.36) PRF1ROCK2BAZ2BALDH1A1MAPK1
SCHEMBL17332084 0.82 MAOA (0.36) ROCK2BAZ2BMAPK1MAOAMAOB
SCHEMBL14966534 0.82 BAZ2B (0.46) AAK1ROCK2BAZ2BALDH1A1MAPK1
SCHEMBL18634514 0.81 ATM (0.41) AAK1ROCK2BAZ2BALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11192875-B2 Processes for preparing antiviral compounds GILEAD PHARMASSET LLC (US) 2021-12-07 — — US disclosed
US-20200392100-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2020-12-17 — — US disclosed
US-10584109-B2 Processes for preparing antiviral compounds Gillead Pharmasset LLC (US) 2020-03-10 — — US disclosed
US-20190263771-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2019-08-29 — — US disclosed
US-20180179175-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC 2018-06-28 — — US disclosed
US-9890134-B2 Processes for preparing antiviral compounds GILEAD PHARMASSET LLC (US) 2018-02-13 — — US disclosed
US-20170283390-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2017-10-05 — — US disclosed
US-9670187-B2 Processes for preparing antiviral compounds GILEAD PHARMASSET LLC (US) 2017-06-06 — — US disclosed
EP-3154984-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS Gilead Pharmasset LLC (US) 2017-04-19 — — EP disclosed
WO-2015191437-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC (US) 2015-12-17 — — WO disclosed
US-20150361073-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2015-12-17 — — 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 (7 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-10584109-B2 Processes for preparing antiviral compounds MAVS, EIF2AK2, SAMHD1 ADRB2 4296/4885ADRB1 3962/4885ADRB3 4232/4885
US-11192875-B2 Processes for preparing antiviral compounds MAVS, EIF2AK2, SAMHD1 ADRB2 4296/4885ADRB1 3962/4885ADRB3 4232/4885
US-20170283390-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SAMHD1 ADRB2 4296/4885ADRB1 3962/4885ADRB3 4232/4885
US-20150361073-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SAMHD1 ADRB2 4296/4885ADRB1 3962/4885ADRB3 4232/4885
US-20180179175-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SAMHD1 ADRB2 4296/4885ADRB1 3962/4885ADRB3 4232/4885
US-20200392100-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SAMHD1 ADRB2 4296/4885ADRB1 3962/4885ADRB3 4232/4885
US-20190263771-A1 PROCESSES FOR PREPARING ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SAMHD1 ADRB2 4296/4885ADRB1 3962/4885ADRB3 4232/4885

“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.

Send feedback