SCHEMBL20899894

SCHEMBL20899894

N#Cc1ccc(C(N)CO)cc1-c1ncnn1C(F)F

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 4/20 0.32
MBOAT4 Q96T53 2/20 0.32
CYP19A1 P11511 2/20 0.31
P2RX3 P56373 1/20 0.30
P2RX2 Q9UBL9 1/20 0.30

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
SCHEMBL20908251 1.00 EGLN2 (0.32) EGLN2MBOAT4CYP19A1P2RX3P2RX2
SCHEMBL30557360 1.00 EGLN2 (0.32) EGLN2MBOAT4CYP19A1P2RX3P2RX2
SCHEMBL20899981 0.83 MAPK1 (0.33)
SCHEMBL20900146 0.83 MAPK1 (0.33)
SCHEMBL30557162 0.82 GABRG2 (0.33)
SCHEMBL20899954 0.82 GABRG2 (0.33)
SCHEMBL20899952 0.82 GABRG2 (0.33)
SCHEMBL20900296 0.82 MAPK1 (0.36) EGLN2P2RX3P2RX2
SCHEMBL20900293 0.82 MAPK1 (0.36) EGLN2P2RX3P2RX2
Hydrochloric Acid SCHEMBL21112528 0.81 GABRG2 (0.32)

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
EP-3694846-B1 1-BENZYL-2-IMINO-4-PHENYL-5-OXOIMIDAZOLIDINE DERIVATIVES AS HIV PROTEASE INHIBITORS GILEAD SCIENCES INC (US) 2024-05-08 EP disclosed
CN-111212832-B 1-Benzyl-2-imino-4-phenyl-5-oxoimidazolidine derivatives as HIV protease inhibitors 吉利德科学公司 2023-09-15 CN disclosed
US-11352329-B2 HIV protease inhibitors GILEAD SCIENCES, INC. (US) 2022-06-07 US disclosed
US-20210078959-A1 HIV PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2021-03-18 US disclosed
US-10774053-B2 HIV protease inhibitors GILEAD SCIENCES, INC. (US) 2020-09-15 US disclosed
EP-3694846-A1 1-BENZYL-2-IMINO-4-PHENYL-5-OXOIMIDAZOLIDINE DERIVATIVES AS HIV PROTEASE INHIBITORS Gilead Sciences, Inc. (US) 2020-08-19 EP disclosed
CN-111212832-A 1-benzyl-2-imino-4-phenyl-5-oxoimidazolidine derivatives as HIV protease inhibitors 吉利德科学公司 2020-05-29 CN disclosed
US-20190210978-A1 HIV PROTEASE INHIBITORS GILEAD SCIENCES, INC. (US) 2019-07-11 US disclosed
WO-2019075291-A1 1-BENZYL-2-IMINO-4-PHENYL-5-OXOIMIDAZOLIDINE DERIVATIVES AS HIV PROTEASE INHIBITORS GILEAD SCIENCES, INC. (US) 2019-04-18 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 (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-20210078959-A1 HIV PROTEASE INHIBITORS PRSS1, SERPINB1, FURIN EGLN2 583/4885MBOAT4 4757/4885CYP19A1 505/4885
US-10774053-B2 HIV protease inhibitors PRSS1, SERPINB1, FURIN EGLN2 583/4885MBOAT4 4757/4885CYP19A1 505/4885
US-11352329-B2 HIV protease inhibitors PRSS1, SERPINB1, FURIN EGLN2 583/4885MBOAT4 4757/4885CYP19A1 505/4885
US-20190210978-A1 HIV PROTEASE INHIBITORS PRSS1, SERPINB1, HPN EGLN2 203/4885MBOAT4 4858/4885CYP19A1 452/4885

“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.