SCHEMBL6059596

SCHEMBL6059596

CC(NC(C)(C)C)C(=O)c1ccccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 5/20 0.55
SLC6A3 Q01959 5/20 0.55
CHRNA1 P02708 4/20 0.55
CHRNG P07510 4/20 0.55
CHRNB1 P11230 4/20 0.55
CHRNB2 P17787 4/20 0.55
CHRNB4 P30926 4/20 0.55
CHRNA3 P32297 4/20 0.55
CHRNA4 P43681 4/20 0.55
CHRND Q07001 4/20 0.55
SLC6A4 P31645 3/20 0.55
CYP2C19 P33261 2/20 0.55
ITGA5 P08648 1/20 0.55
HRH1 P35367 1/20 0.55
CHRNA7 P36544 1/20 0.55
OPRK1 P41145 1/20 0.55
KCNH2 Q12809 1/20 0.55
ALDH1A1 P00352 3/20 0.54
BLM P54132 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
Hydrochloric Acid SCHEMBL30450072 0.98 SLC6A2 (0.56) SLC6A2SLC6A3CHRNA1CHRNGCHRNB1
SCHEMBL4399935 0.84 CYP2B6 (0.59) SLC6A2SLC6A3CHRNA1CHRNGCHRNB1
SCHEMBL836614 0.77 TRPA1 (0.44) ALDH1A1SMN1; SMN2HTTPOLBCES2
SCHEMBL836615 0.77 TRPA1 (0.44) ALDH1A1SMN1; SMN2HTTPOLBCES2
SCHEMBL2632778 0.76 CES2 (0.58) CYP2C19ALDH1A1POLBCES2CES1
SCHEMBL769768 0.75 SLC6A3 (0.66) SLC6A2SLC6A3CHRNA1CHRNGCHRNB1
SCHEMBL18074005 0.75 POLB (0.48) CYP2C19ALDH1A1SMN1; SMN2POLBCES2
SCHEMBL4401492 0.74 NPC1 (0.48) CYP2C19ALDH1A1SMN1; SMN2POLBCES2
Hydrochloric Acid SCHEMBL10618419 0.74 SLC6A2 (0.67) SLC6A2SLC6A3CHRNA1CHRNGCHRNB1
SCHEMBL30529376 0.73 CES2 (0.54) CYP2C19ALDH1A1POLBCES2CES1

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4741383-A1 COMPOUND AND USE THEREOF AS ANTI-CANCER DRUG Tyligand Bioscience (Shanghai) Limited (CN) 2026-05-13 EP disclosed
US-20250312469-A1 FL118 COMPLEXES FOR TARGETING DDX5, UbE2T or USP2a CANGET BIOTEKPHARMA, LLC 2025-10-09 US disclosed
US-12298320-B2 Compound distribution in microfluidic devices EMULATE, Inc. (US) 2025-05-13 US disclosed
US-20250108064-A1 PHOSPHATE PRODRUGS OF CANNABINOIDS EMORY UNIVERSITY (US) 2025-04-03 US disclosed
US-20250017932-A1 Methods of Administering Elagolix ABBVIE INC (US) 2025-01-16 US disclosed
EP-3998073-B1 DEVICES AND METHODS FOR SIMULATING A FUNCTION OF A LIVER TISSUE EMULATE INC (US) 2024-11-06 EP disclosed
US-20240279612-A1 LIVER ORGANOID MANUFACTURING METHODS, LIVER ORGANOIDS OBTAINED WITH THE SAME, AND USES THEREOF HCS PHARMA (FR) 2024-08-22 US disclosed
CN-118510544-A Cannabinoids phosphate prodrugs 爱莫里大学 2024-08-16 CN disclosed
US-12019083-B2 Compound distribution in microfluidic devices EMULATE, Inc. (US) 2024-06-25 US disclosed
EP-4376893-A2 PHOSPHATE PRODRUGS OF CANNABINOIDS Emory University (US) 2024-06-05 EP disclosed
US-20220334139-A1 COMPOUND DISTRIBUTION IN MICROFLUIDIC DEVICES EMULATE, Inc. 2022-10-20 US disclosed
US-20220257597-A1 Methods of Administering Elagolix ABBVIE INC. (US) 2022-08-18 US disclosed
WO-2022165097-A1 METHODS OF ADMINISTRATING ELAGOLIX ABBVIE INC. (US) 2022-08-04 WO disclosed
US-20220168307-A1 TREATMENT OF SMA HOFFMANN-LA ROCHE INC. (US) 2022-06-02 US disclosed
US-20220155328-A1 COMPOUND DISTRIBUTION IN MICROFLUIDIC DEVICES EMULATE, Inc. 2022-05-19 US disclosed
EP-3998073-A1 DEVICES AND METHODS FOR SIMULATING A FUNCTION OF A LIVER Emulate, Inc. (US) 2022-05-18 EP disclosed
EP-3990186-A1 COMPOUND DISTRIBUTION IN MICROFLUIDIC DEVICES Emulate, Inc. (US) 2022-05-04 EP disclosed
EP-1420795-A4 AS-NEEDED ADMINISTRATION OF AN ANDROGENIC AGENT TO ENHANCE FEMALE SEXUAL DESIRE AND RESPONSIVENESS VIVUS INC (US) 2006-09-06 EP disclosed
EP-1420795-A1 AS-NEEDED ADMINISTRATION OF AN ANDROGENIC AGENT TO ENHANCE FEMALE SEXUAL DESIRE AND RESPONSIVENESS Vivus, Inc. (US) 2004-05-26 EP disclosed
WO-2003011301-A1 AS-NEEDED ADMINISTRATION OF AN ANDROGENIC AGENT TO ENHANCE FEMALE SEXUAL DESIRE AND RESPONSIVENESS VIVUS, INC. (US) 2003-02-13 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 (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-20220257597-A1 Methods of Administering Elagolix CYP2D6, CYP19A1, CYP2B6 SLC6A2 1456/4885SLC6A3 1336/4885CHRNA1 1537/4885
US-20250312469-A1 FL118 COMPLEXES FOR TARGETING DDX5, UbE2T or USP2a USP8, DDX18, UBE2T SLC6A2 4485/4885SLC6A3 4109/4885CHRNA1 4732/4885
US-20250017932-A1 Methods of Administering Elagolix CYP2D6, CYP19A1, CYP2B6 SLC6A2 1456/4885SLC6A3 1336/4885CHRNA1 1537/4885
US-20250108064-A1 PHOSPHATE PRODRUGS OF CANNABINOIDS CNR1, CNR2, PLCB3 SLC6A2 653/4885SLC6A3 458/4885CHRNA1 1079/4885
US-20220168307-A1 TREATMENT OF SMA SMN1; SMN2, MTPN, CPT1B SLC6A2 3019/4885SLC6A3 4351/4885CHRNA1 688/4885

“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.