SCHEMBL15723970

SCHEMBL15723970

CC(C)c1ncccc1-c1cccc(C(=O)N2CCOCC2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.55
MEN1 O00255 1/20 0.54
RAB9A P51151 1/20 0.54
KMT2A Q03164 1/20 0.54
PLK4 O00444 1/20 0.51
JAK2 O60674 1/20 0.51
MAP4K4 O95819 1/20 0.51
ROS1 P08922 1/20 0.51
FGFR1 P11362 1/20 0.51
FLT1 P17948 1/20 0.51
MARK3 P27448 1/20 0.51
FLT4 P35916 1/20 0.51
KDR P35968 1/20 0.51
FLT3 P36888 1/20 0.51
CLK2 P49760 1/20 0.51
CSNK1G2 P78368 1/20 0.51
MAP4K2 Q12851 1/20 0.51
ROCK1 Q13464 1/20 0.51
NTRK3 Q16288 1/20 0.51
MINK1 Q8N4C8 1/20 0.51

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
SCHEMBL15730181 0.86 HPGD (0.57) HPGDMEN1RAB9AKMT2APLK4
SCHEMBL12141974 0.79 SMN1; SMN2 (0.53) HSP90AA1HSP90AB1KDM4E
SCHEMBL14555416 0.78 MEN1 (0.46) MEN1RAB9AKMT2APLK4JAK2
SCHEMBL18853950 0.76 PRKCI (0.50) RAB9APLK4ROS1FGFR1FLT1
SCHEMBL4937468 0.76 HPGD (0.56) HPGDMEN1RAB9AKMT2APLK4
SCHEMBL3514538 0.75 HPGD (0.50) HPGDMEN1RAB9AKMT2APLK4
SCHEMBL104536 0.75 L3MBTL1 (0.62) HPGDMEN1RAB9AKMT2AL3MBTL1
SCHEMBL20371521 0.74 PLK1 (0.48) MAP4K4KDRRIPK1
SCHEMBL15723874 0.74 KCNA5 (0.53) ERN1
SCHEMBL15723879 0.74 L3MBTL1 (0.40) HPGDRAB9AL3MBTL1

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-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-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-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2014-05-22 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 (5 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-20180194746-A1 Compounds For the Treatment of HIV CCR5, NPC1, FURIN HPGD 1093/4885MEN1 2645/4885RAB9A 357/4885
US-11034668-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN HPGD 1093/4885MEN1 2645/4885RAB9A 357/4885
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN HPGD 1093/4885MEN1 2645/4885RAB9A 357/4885
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN HPGD 1093/4885MEN1 2645/4885RAB9A 357/4885
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN HPGD 1093/4885MEN1 2645/4885RAB9A 357/4885

“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.