SCHEMBL18853897

SCHEMBL18853897

CC(C)c1ncccc1-c1ccc(NS(C)(=O)=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 2/20 0.49
▸ CHUK O15111 2/20 0.49
▸ MAPK10 P53779 3/20 0.48
▸ KLK7 P49862 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ CYP17A1 P05093 1/20 0.45
▸ KIF11 P52732 2/20 0.45
▸ MET P08581 1/20 0.44
▸ KEAP1 Q14145 1/20 0.43
▸ GLO1 Q04760 2/20 0.43
▸ CKS1B P61024 1/20 0.43
▸ SKP2 Q13309 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL15730159 0.83 IKBKB (0.53) IKBKBCHUKMAPK10KLK7MEN1
SCHEMBL14555904 0.80 PTGS2 (0.61) —
SCHEMBL20371667 0.78 IKBKB (0.48) IKBKBCHUKMAPK10KLK7MEN1
SCHEMBL20851459 0.78 GLO1 (0.58) KEAP1GLO1CKS1BSKP2KDM4E
SCHEMBL10094331 0.77 CA12 (0.58) IKBKBCHUKMAPK10KIF11KEAP1
SCHEMBL14555426 0.77 SMN1; SMN2 (0.51) MEN1KMT2ACKS1BSKP2KDM4E
SCHEMBL18853896 0.77 DRD1 (0.50) IKBKBCHUKMEN1KMT2AALDH1A1
SCHEMBL14555429 0.76 CA2 (0.60) IKBKBCHUK
SCHEMBL18853879 0.75 NPSR1 (0.48) MEN1KMT2AALDH1A1NPSR1
SCHEMBL15723905 0.74 KMT2A (0.48) MEN1KMT2AKDM4EALDH1A1MAPT

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 4 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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-11034668-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN IKBKB 1454/4885CHUK 1089/4885MAPK10 943/4885
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN IKBKB 1454/4885CHUK 1089/4885MAPK10 943/4885
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN IKBKB 1454/4885CHUK 1089/4885MAPK10 943/4885

“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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