SCHEMBL909982

SCHEMBL909982

CCCCCCCCCCC(S)n1ccnc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 4/20 0.47
CYP17A1 P05093 6/20 0.43
CYP19A1 P11511 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
TBXA2R P21731 1/20 0.34
PIK3R1 P27986 1/20 0.33
AKT1 P31749 1/20 0.33
AKT2 P31751 1/20 0.33
PIK3CA P42336 1/20 0.33
AKT3 Q9Y243 1/20 0.33

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
SCHEMBL20397442 0.98 CYP17A1 (0.44) TBXAS1CYP17A1CYP19A1CYP3A4CYP2D6
SCHEMBL6060901 0.93 CYP17A1 (0.49) TBXAS1CYP17A1CYP19A1CYP3A4CYP2D6
SCHEMBL20397466 0.85 CYP17A1 (0.46) TBXAS1CYP17A1CYP19A1
SCHEMBL28417238 0.82 TBXAS1 (0.50) TBXAS1CYP17A1CYP19A1CYP3A4CYP2D6
SCHEMBL18885407 0.82 TBXAS1 (0.50) TBXAS1CYP17A1CYP19A1CYP3A4CYP2D6
SCHEMBL3851254 0.82 TBXAS1 (0.50) TBXAS1CYP17A1CYP19A1CYP3A4CYP2D6
SCHEMBL19611321 0.82 TBXAS1 (0.50) TBXAS1CYP17A1CYP19A1CYP3A4CYP2D6
SCHEMBL3421199 0.82 TBXAS1 (0.50) TBXAS1CYP17A1CYP19A1CYP3A4CYP2D6
SCHEMBL28566983 0.82 TBXAS1 (0.50) TBXAS1CYP17A1CYP19A1CYP3A4CYP2D6
SCHEMBL29220056 0.82 TBXAS1 (0.50) TBXAS1CYP17A1CYP19A1CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3989920-A1 ADDITIVES FOR COLORING AGENTS AND METHODS OF USE THEREOF Living Proof, Inc. (US) 2022-05-04 EP claimed
WO-2020264257-A1 ADDITIVES FOR COLORING AGENTS AND METHODS OF USE THEREOF LIVING PROOF, INC. (US) 2020-12-30 WO claimed
EP-3651854-A1 HETEROCYCLIC-DITHIOL CLICK CHEMISTRY Northeastern University (US) 2020-05-20 EP claimed
WO-2019014311-A1 HETEROCYCLIC-DITHIOL CLICK CHEMISTRY NORTHEASTERN UNIVERSITY (US) 2019-01-17 WO claimed
EP-2594248-A1 Active ingredient combination and use thereof Air Liquide Santé (International) (FR) 2013-05-22 EP claimed
US-20100310487-A1 ACTIVE INGREDIENT COMBINATION AND USE THEREOF AIR LIQUIDE SANTE (INTERNATIONAL) (FR) 2010-12-09 US claimed
EP-2257267-A2 ACTIVE INGREDIENT COMBINATION AND USE THEREOF Air Liquide Santé (International) (FR) 2010-12-08 EP claimed
WO-2009106468-A2 ACTIVE INGREDIENT COMBINATION AND USE THEREOF AIR LIQUIDE SANTE (INTERNATIONAL) (FR) 2009-09-03 WO claimed
EP-1301168-B1 STORAGE-STABLE COMPOSITIONS OF GLYCEROL MONOALKYL ETHERS AIR LIQUIDE SANTE INT (FR) 2007-08-01 EP claimed
EP-1806123-A2 Storage-stable compositions of glycerol monoalkyl ethers Air Liquide Santé (International) (FR) 2007-07-11 EP claimed
US-20050238681-A1 Storage-stable compositions of glycerol monoalkyl ethers SCHULKE & MAYR GMBH (DE) 2005-10-27 US claimed
US-20030149097-A1 Storage-stable compositions of glycerol monoalkyl ethers ASHLAND SPECIALTIES DEUTSCHLAND GMBH (DE) 2003-08-07 US claimed
EP-1301168-A1 STORAGE-STABLE COMPOSITIONS OF GLYCEROL MONOALKYL ETHERS Air Liquide Santé (International) (FR) 2003-04-16 EP claimed
WO-2001093825-A1 STORAGE-STABLE COMPOSITIONS OF GLYCEROL MONOALKYL ETHERS AIR LIQUIDE SANTE (INTERNATIONAL) (FR) 2001-12-13 WO claimed
WO-2026104886-A1 METHOD FOR EXTRACTING LOW-MOLECULAR WEIGHT COLLAGEN USING POLLACK SKIN, LOW-MOLECULAR WEIGHT COLLAGEN, AND COSMETIC COMPOSITION COMPRISING SAME WITH SKIN REGENERATION EFFICACY 유엔케이코리아 주식회사 2026-05-21 WO disclosed
US-20250090435-A1 PRESERVATIVES FOR COSMETIC AND PHARMACEUTICAL COMPOSITIONS SACHEM, INC. (US) 2025-03-20 US disclosed
EP-4376798-A1 PRESERVATIVES FOR COSMETIC AND PHARMACEUTICAL COMPOSITIONS Sachem, Inc. (US) 2024-06-05 EP disclosed
US-20050238681-A1 Storage-stable compositions of glycerol monoalkyl ethers SCHULKE & MAYR GMBH (DE) 2005-10-27 US disclosed
US-6956062-B2 Storage-stable compositions of glycerol monoalkyl ethers Air Liquide Santé (International) (FR) 2005-10-18 US disclosed
US-20030149097-A1 Storage-stable compositions of glycerol monoalkyl ethers ASHLAND SPECIALTIES DEUTSCHLAND GMBH (DE) 2003-08-07 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 (2 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-20250090435-A1 PRESERVATIVES FOR COSMETIC AND PHARMACEUTICAL COMPOSITIONS PLOD2, CUTA, PHOSPHO1 TBXAS1 2342/4885CYP17A1 61/4885CYP19A1 49/4885
US-20100310487-A1 ACTIVE INGREDIENT COMBINATION AND USE THEREOF POLR1C, CUTA, CAT TBXAS1 4832/4885CYP17A1 282/4885CYP19A1 708/4885

“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.