SCHEMBL236624

SCHEMBL236624

O=C(O)C=Cc1cccc(Br)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 1/20 0.76
NPSR1 Q6W5P4 2/20 0.62
HDAC3 O15379 1/20 0.61
TNKS O95271 1/20 0.61
HDAC4 P56524 1/20 0.61
HDAC1 Q13547 1/20 0.61
HCAR2 Q8TDS4 1/20 0.61
HDAC7 Q8WUI4 1/20 0.61
HDAC2 Q92769 1/20 0.61
HDAC10 Q969S8 1/20 0.61
HDAC11 Q96DB2 1/20 0.61
HDAC8 Q9BY41 1/20 0.61
TNKS2 Q9H2K2 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61
HDAC9 Q9UKV0 1/20 0.61
HDAC5 Q9UQL6 1/20 0.61
SLC6A19 Q695T7 1/20 0.59
BACE1 P56817 1/20 0.59
CYP2D6 P10635 1/20 0.58
CYP1B1 Q16678 1/20 0.58

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
SCHEMBL31320929 1.00 HSD17B3 (0.76) HSD17B3NPSR1HDAC3TNKSHDAC4
SCHEMBL236623 1.00 HSD17B3 (0.76) HSD17B3NPSR1HDAC3TNKSHDAC4
SCHEMBL8937628 1.00 HSD17B3 (0.76) HSD17B3NPSR1HDAC3TNKSHDAC4
SCHEMBL11470768 0.98 HSD17B3 (0.73) HSD17B3NPSR1HDAC3TNKSHDAC4
Hydrochloric Acid SCHEMBL6818198 0.98 HSD17B3 (0.73) HSD17B3NPSR1HDAC3TNKSHDAC4
SCHEMBL1035544 0.86 HSD17B3 (0.79) HSD17B3NPSR1SLC6A19BACE1CYP2D6
SCHEMBL1035543 0.86 HSD17B3 (0.79) HSD17B3NPSR1SLC6A19BACE1CYP2D6
SCHEMBL271386 0.86 NPSR1 (0.74) HSD17B3NPSR1HDAC3TNKSHDAC4
SCHEMBL69146 0.86 NPSR1 (0.74) HSD17B3NPSR1HDAC3TNKSHDAC4
SCHEMBL29162914 0.85 HSD17B3 (0.71) HSD17B3NPSR1SLC6A19BACE1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4661890-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS Purdue Research Foundation (US) 2025-12-17 EP claimed
CN-117430128-B Preparation method and application of copper-doped ZSM-5 zeolite molecular sieve containing mesoporous structure 常州大学 2025-04-25 CN claimed
CN-117430125-B Preparation method and application of manganese doped mesoporous structure-containing acidic Beta zeolite molecular sieve 常州大学 2025-03-21 CN claimed
CN-118955813-A Low-temperature early-strength water reducer and preparation method thereof 北京工业大学 2024-11-15 CN claimed
WO-2024167565-A1 PTP1B/TC-PTP DUAL INHIBITORS AND PROTEIN DEGRADERS PURDUE RESEARCH FOUNDATION (US) 2024-08-15 WO claimed
CN-117430125-A Preparation method and application of manganese doped mesoporous structure-containing acidic Beta zeolite molecular sieve 常州大学 2024-01-23 CN claimed
CN-117430128-A Preparation method and application of copper-doped ZSM-5 zeolite molecular sieve containing mesoporous structure 常州大学 2024-01-23 CN claimed
CN-115925743-A Method for preparing (2-oxo-2-aryl ethyl) diaryl phosphine oxide compound 湖南理工学院 2023-04-07 CN claimed
CN-109265458-B Matrine-based antitumor drug compound 中国医学科学院药用植物研究所 2020-09-15 CN claimed
CN-109265458-A A kind of antineoplastic compounds based on matrine 中国医学科学院药用植物研究所 2019-01-25 CN claimed
US-20060020141-A1 Metallized dye XEROX CORPORATION 2006-01-26 US claimed
US-20060000778-A1 high-performance membrane designed for the selective removal of a polar fluid (water) from less polar fluids (organic solvents), by a pervaporation using a composite membrane contaiing ultrafiltration membrane as support ( e.g. cellulose acetate) and a crosslinked copolymer of anionic, cationic monomers MCMASTER UNIVERSITY (CA) 2006-01-05 US claimed
WO-2005102503-A1 PERVAPORATION COMPOSITE MEMBRANES MCMASTER UNIVERSITY (CA) 2005-11-03 WO claimed
US-6946025-B2 Process for preparing tetra-amide compounds XEROX CORPORATION (US) 2005-09-20 US claimed
CN-1655057-A Photosensitive semiconductor nanocrystals, photosensitive composition comprising semiconductor nanocrystals and uses thereof SAMSUNG ELECTRONICS CO LTD (KR) 2005-08-17 CN claimed
US-20050161666-A1 Photosensitive semiconductor nanocrystals, photosensitive composition comprising semiconductor nanocrystals and method for forming semiconductor nanocrystal pattern using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2005-07-28 US claimed
US-20050090690-A1 Process for preparing tetra-amide compounds XEROX CORPORATION 2005-04-28 US claimed
EP-1526584-A2 Photosensitive semiconductor nanocrystals, photosensitive composition comprising semiconductor nanocrystals and method for forming semiconductor nanocrystal pattern using the same Samsung Electronics Co., Ltd (KR) 2005-04-27 EP claimed
EP-1015505-B1 PRODUCTION OF PHOTOPOLYMERIZED POLYESTER HIGH INDEX OPHTHALMIC LENSES SIGNET ARMORLITE INC (US) 2005-03-09 EP claimed
EP-0783710-B1 POLYESTER RESIN-BASED HIGH INDEX OPHTHALMIC LENSES HAVING IMPROVED OPTICAL UNIFORMITY AND/OR TINTABILITY SIGNET ARMORLITE INC (US) 2002-05-29 EP claimed

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-20060020141-A1 Metallized dye CDYL, CDY1; CDY1B, CDYL2 HSD17B3 2354/4885NPSR1 2989/4885HDAC3 1033/4885
US-20050090690-A1 Process for preparing tetra-amide compounds TAF9, TAF5, TAF1 HSD17B3 4158/4885NPSR1 3033/4885HDAC3 849/4885

“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.