SCHEMBL29349652

SCHEMBL29349652

OB(O)c1ccc(C(F)(F)F)cc1C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.50
MGLL Q99685 2/20 0.48
TRPV6 Q9H1D0 2/20 0.43
ORAI1 Q96D31 1/20 0.43
ORAI2 Q96SN7 1/20 0.43
ORAI3 Q9BRQ5 1/20 0.43
PDE2A O00408 3/20 0.38
POLQ O75417 3/20 0.38
AR P10275 1/20 0.37
NOTUM Q6P988 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
PTPN5 P54829 1/20 0.35
KIF11 P52732 1/20 0.35

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
SCHEMBL496773 1.00 CES2 (0.50) CES2MGLLTRPV6ORAI1ORAI2
SCHEMBL24425083 0.88 ALDH1A1 (0.41) CES2MGLLTRPV6ORAI1ORAI2
SCHEMBL1670722 0.87 CES2 (0.40) CES2MGLLTRPV6ORAI1ORAI2
SCHEMBL1668958 0.84 MGLL (0.42) CES2MGLLTRPV6ORAI1ORAI2
SCHEMBL22695061 0.83 CES2 (0.46) CES2MGLLTRPV6ORAI1ORAI2
SCHEMBL29689581 0.83 CES2 (0.50) CES2MGLLTRPV6ORAI1ORAI2
SCHEMBL1243257 0.83 CES2 (0.50) CES2MGLLTRPV6ORAI1ORAI2
SCHEMBL31538169 0.83 CES2 (0.48) CES2MGLLTRPV6ORAI1ORAI2
SCHEMBL1396618 0.83 MGLL (0.52) CES2MGLLTRPV6ORAI1ORAI2
SCHEMBL581357 0.81 MGLL (0.50) CES2MGLLTRPV6ORAI1ORAI2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326709-A1 THE MICROWAVE-ASSISTED CATALYTIC AMIDATION OF ORGANIC AMINES WITH CARBOXYLIC ACIDS PURDUE RESEARCH FOUNDATION (US) 2025-10-23 US claimed
CN-120033221-A Silicon-based composite material, preparation method thereof and secondary battery 兰溪致德新能源材料有限公司 2025-05-23 CN claimed
EP-4280882-A2 MATERIALS AND METHODS FOR EXTENDING SHELF-LIFE OF FOODS JP LABORATORIES, INC. (US) 2023-11-29 EP claimed
CN-116916755-A Materials and methods for extending the shelf life of food products JP实验室公司 2023-10-20 CN claimed
WO-2022159439-A2 MATERIALS AND METHODS FOR EXTENDING SHELF-LIFE OF FOODS JP LABORATORIES, INC. (US) 2022-07-28 WO claimed
CN-114195812-A Method for synthesizing 2, 4-bis (trifluoromethyl) phenylboronic acid 大连联化化学有限公司 2022-03-18 CN claimed
CN-122079945-A Coumarin derivative containing substituted phenyl ether structure, preparation method and application thereof 2026-05-26 CN disclosed
US-20250326709-A1 THE MICROWAVE-ASSISTED CATALYTIC AMIDATION OF ORGANIC AMINES WITH CARBOXYLIC ACIDS PURDUE RESEARCH FOUNDATION (US) 2025-10-23 US disclosed
WO-2025215450-A1 THIAZOLE COMPOUNDS AS SODIUM CHANNEL BLOCKERS SK BIOPHARMACEUTICALS CO., LTD. (KR) 2025-10-16 WO disclosed
US-20250169514-A1 Materials and Methods for Extending Shelf-Life of Foods JP LABORATORIES, INC. 2025-05-29 US disclosed
CN-120033221-A Silicon-based composite material, preparation method thereof and secondary battery 兰溪致德新能源材料有限公司 2025-05-23 CN disclosed
CN-115716838-B Organic electroluminescent material and device 北京夏禾科技有限公司 2025-04-29 CN disclosed
CN-119798276-A Organic compound and application thereof 北京燕化集联光电技术有限公司 2025-04-11 CN disclosed
CN-114981278-A Compound and optical film comprising same 株式会社LG化学 2022-08-30 CN disclosed
CN-114539287-A Polycyclic aromatic compound and application thereof in electroluminescent device 清华大学 2022-05-27 CN disclosed
CN-114195812-A Method for synthesizing 2, 4-bis (trifluoromethyl) phenylboronic acid 大连联化化学有限公司 2022-03-18 CN disclosed
CN-114195812-A Method for synthesizing 2, 4-bis (trifluoromethyl) phenylboronic acid 大连联化化学有限公司 2022-03-18 CN disclosed
CN-114195812-A Method for synthesizing 2, 4-bis (trifluoromethyl) phenylboronic acid 大连联化化学有限公司 2022-03-18 CN disclosed
CN-114008055-A Compound and optical film comprising same 株式会社LG化学 2022-02-01 CN disclosed
CN-113956295-A Iridium metal complex, application thereof and organic electroluminescent device 清华大学 2022-01-21 CN 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 (1 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-20250326709-A1 THE MICROWAVE-ASSISTED CATALYTIC AMIDATION OF ORGANIC AMINES WITH CARBOXYLIC ACIDS NAAA, OAT, PAM CES2 1258/4885MGLL 506/4885TRPV6 4435/4885

“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.