SCHEMBL1987884

SCHEMBL1987884

CC(C)(C)c1cc([Mg]Br)cc(C(C)(C)C)c1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.52
GABRB2 P47870 1/20 0.52
POLB P06746 1/20 0.37
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
HTR1D P28221 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.30
BCHE P06276 1/20 0.30
ACHE P22303 1/20 0.30

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
Formic Acid SCHEMBL31140087 0.87 GABRA1 (0.46) GABRA1GABRB2POLBKDM4EMAPT
SCHEMBL664647 0.77 HDAC8 (0.42) GABRA1GABRB2GAAMAPTRXRA
SCHEMBL93161 0.76 GABRA1 (0.69) GABRA1GABRB2POLBKDM4EGAA
SCHEMBL663624 0.74 TSHR (0.48) MAPTALDH1A1HPGDALOX15HSD17B10
SCHEMBL14763886 0.74 GABRA1 (0.46) GABRA1GABRB2POLBKDM4EGAA
SCHEMBL432591 0.74 CES2 (0.41) MAPTRXRARXRBRXRGALDH1A1
SCHEMBL3162653 0.74 GABRA1 (0.46) GABRA1GABRB2POLBKDM4EGAA
SCHEMBL10394690 0.73 GABRA1 (0.65) GABRA1GABRB2POLBKDM4EGAA
SCHEMBL10415675 0.73 GABRA1 (0.65) GABRA1GABRB2POLBKDM4EGAA
Bromide SCHEMBL2959626 0.72 TSHR (0.46) MAPTALDH1A1HPGDALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115448918-B Phenanthroline ligand and application thereof in copper-catalyzed aryl halide coupling reaction 江西德璟生物科技有限公司 2023-07-25 CN claimed
US-12520720-B2 Heterocyclic compound and organic light-emitting device SAMSUNG ELECTRONICS CO., LTD. (KR) 2026-01-06 US disclosed
EP-3617202-B1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO LTD (KR) 2025-11-05 EP disclosed
CN-119462781-A Ligand, catalyst, chiral alcohol and synthesis method thereof 深圳格林凯特医药技术有限公司 2025-02-18 CN disclosed
CN-115448918-B Phenanthroline ligand and application thereof in copper-catalyzed aryl halide coupling reaction 江西德璟生物科技有限公司 2023-07-25 CN disclosed
US-11578148-B2 Metal complex comprising amidine and thiophene fused cyclopentadienyl ligands ARLANXEO NETHERLANDS B.V. 2023-02-14 US disclosed
CN-110177798-B Catalyst and process for preparing same 博里利斯股份公司 2022-08-30 CN disclosed
CN-114644662-A Chiral phosphine nitrogen tridentate ligand based on ferrocene structure and application thereof 广东工业大学 2022-06-21 CN disclosed
US-11352376-B2 Catalysts BOREALIS AG (AT) 2022-06-07 US disclosed
EP-3732183-B1 METAL COMPLEX COMPRISING AMIDINE AND THIOPHENE FUSED CYCLOPENTADIENYL LIGANDS Arlanxeo Netherlands Bv (NL) 2021-10-20 EP disclosed
US-6380120-B1 AS POLYMERIZATION CATALYST EXXONMOBIL CHEMICAL PATENTS INC. 2002-04-30 US disclosed
US-6376627-B1 COORDINATION CATALYSTS EXXONMOBIL CHEMICAL PATENTS INC. 2002-04-23 US disclosed
US-6376410-B1 COORDINATION POLYMERIZATION CATALYST ON SUPPORT EXXONMOBIL CHEMICAL PATENTS INC. 2002-04-23 US disclosed
US-6376407-B1 COORDINATION POLYMERIZATION CATALYST EXXONMOBIL CHEMICAL PATENTS INC. 2002-04-23 US disclosed
US-6376408-B1 COORDINATION POLYMERIZATION CATALYST ON SUPPORT EXXONMOBIL CHEMICAL PATENTS INC. 2002-04-23 US disclosed
US-6376412-B1 COORDINATION POLYMERIZATION CATALYST ON SUPPORT EXXONMOBIL CHEMICAL PATENTS INC. 2002-04-23 US disclosed
US-6376409-B1 COORDINATION POLYMERIZATION CATALYST ON SUPPORT EXXONMOBIL CHEMICAL PATENTS INC. 2002-04-23 US disclosed
US-6376413-B1 COORDINATION POLYMERIZATION CATALYST ON SUPPORT EXXONMOBIL CHEMICAL PATENTS INC. 2002-04-23 US disclosed
US-6376411-B1 COORDINATION POLYMERIZATION CATALYST ON SUPPORT EXXONMOBIL CHEMICAL PATENTS INC. 2002-04-23 US disclosed
WO-2002002575-A1 METALLOCENES WITH A BRIDGED 4-PHENYL-INDENYL-LIGAND FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2002-01-10 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 (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-11352376-B2 Catalysts SIGMAR1, H1-2, SFN GABRA1 3084/4885GABRB2 3318/4885POLB 2707/4885
US-11578148-B2 Metal complex comprising amidine and thiophene fused cyclopentadienyl ligands AP3M1, AP2M1, AP1M1 GABRA1 4080/4885GABRB2 4720/4885POLB 3995/4885

“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.