SCHEMBL15833732

SCHEMBL15833732

CC(C)c1cccc(C(C)C)c1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.48
LMNA P02545 3/20 0.48
GABRB2 P47870 2/20 0.48
GABRG2 P18507 2/20 0.48
GABRB3 P28472 2/20 0.48
TSHR P16473 2/20 0.48
FAAH O00519 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
HPGD P15428 1/20 0.48
GABRB1 P18505 1/20 0.48
PTGS1 P23219 1/20 0.48
SLC6A2 P23975 1/20 0.48
HTR2C P28335 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48
HTR2B P41595 1/20 0.48
GABRA2 P47869 1/20 0.48

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
SCHEMBL8134144 0.87 GABRA1 (0.42) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL11314594 0.87 CA1 (0.43) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL28980492 0.87 GABRA1 (0.41) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL11555903 0.85 CYP1A2 (0.42) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL1868729 0.85 GABRA1 (0.59) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL30791332 0.82 KCNK3 (0.47) CA1CA2CYP1A2CYP3A4HPGD
SCHEMBL2048068 0.81 GABRA1 (0.60) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL23058348 0.79 GABRA1 (0.43) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL5670849 0.79 CYP3A4 (0.43) GABRA1LMNAGABRB2GABRG2GABRB3
SCHEMBL1073583 0.79 GABRA1 (0.54) GABRA1LMNAGABRB2GABRG2GABRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119684099-A Preparation method of 3- (3-isopropylphenyl) butyraldehyde 西安凯立新材料股份有限公司 2025-03-25 CN claimed
US-11787827-B2 Triaryl phosphine ligands, preparation method therefor, and use in catalyzing coupling reactions DONGGUAN STEPHEN CATALYST CO., LTD. (CN) 2023-10-17 US claimed
CN-115385956-A Biaryl diphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN claimed
CN-115385957-A Linear terphenyl aryl phosphine ligand and transition metal complex thereof 东莞市均成高新材料有限公司 2022-11-25 CN claimed
CN-115385955-A Tetrabiarylphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN claimed
CN-115181128-A Phosphine ligand of arylmethyl biaryl and transition metal complex thereof 东莞市均成高新材料有限公司 2022-10-14 CN claimed
US-20210147452-A1 TRIARYL PHOSPHINE LIGANDS, PREPARATION METHOD THEREFOR, AND USE IN CATALYSING COUPLING REACTIONS DONGGUAN STEPHEN CATALYST CO., LTD. (CN) 2021-05-20 US claimed
EP-3766891-A1 TRIARYL PHOSPHINE LIGANDS, PREPARATION METHOD THEREFOR, AND USE IN CATALYSING COUPLING REACTIONS Dongguan Stephen Catalyst Co., Ltd. (CN) 2021-01-20 EP claimed
WO-2019170163-A1 TRIARYL PHOSPHINE LIGANDS, PREPARATION METHOD THEREFOR, AND USE IN CATALYSING COUPLING REACTIONS 东莞市均成高新材料有限公司 2019-09-12 WO claimed
US-8766529-B2 Metal complexes of cyclometallated imidazo[1,2-ƒ]phenanthridine and diimidazo[1,2-a:1',2'-c]quinazoline ligands and isoelectronic and benzannulated analogs thereof UNIVERSAL DISPLAY CORPORATION (US) 2014-07-01 US claimed
EP-4703362-A1 COMPOUND CONTAINING OXO-PYRIDO-ALIPHATIC RING OR ALIPHATIC HETEROCYCLIC STRUCTURE, AND MEDICAL USE THEREOF Chengdu Sibeibo Pharmaceutical Technology Co., Ltd (CN) 2026-03-04 EP disclosed
WO-2025061141-A1 PHARMACEUTICAL COMPOSITION HAVING IMPROVED PHARMACOKINETIC PROPERTIES 成都思倍博医药科技有限公司 2025-03-27 WO disclosed
CN-119684099-A Preparation method of 3- (3-isopropylphenyl) butyraldehyde 西安凯立新材料股份有限公司 2025-03-25 CN disclosed
US-12258323-B2 Dihydrooxadiazinones BAYER AKTIENGESELLSCHAFT (DE) 2025-03-25 US disclosed
CN-119604497-A Heteroaromatic carboxamides and their use in medicine 远森制药(杭州)有限公司 2025-03-11 CN disclosed
CN-115181128-A Phosphine ligand of arylmethyl biaryl and transition metal complex thereof 东莞市均成高新材料有限公司 2022-10-14 CN disclosed
US-11427553-B2 Dihydrooxadiazinones BAYER AKTIENGESELLSCHAFT (DE) 2022-08-30 US disclosed
EP-3661917-B1 6-((3-TRIFLUOROMETHYL)PHENYL)-4,5-DIHYDROPYRIDAZIN-3(2H)-ONE DERIVATIVES AS PDE3A AND PDE3B INHIBITORS FOR TREATING CANCER BAYER AG (DE) 2022-05-11 EP disclosed
US-20210147452-A1 TRIARYL PHOSPHINE LIGANDS, PREPARATION METHOD THEREFOR, AND USE IN CATALYSING COUPLING REACTIONS DONGGUAN STEPHEN CATALYST CO., LTD. (CN) 2021-05-20 US disclosed
EP-3766891-A1 TRIARYL PHOSPHINE LIGANDS, PREPARATION METHOD THEREFOR, AND USE IN CATALYSING COUPLING REACTIONS Dongguan Stephen Catalyst Co., Ltd. (CN) 2021-01-20 EP 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 (4 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-11787827-B2 Triaryl phosphine ligands, preparation method therefor, and use in catalyzing coupling reactions WEE1, WEE2, NOTUM GABRA1 958/4885LMNA 4765/4885GABRB2 1914/4885
US-12258323-B2 Dihydrooxadiazinones CCND2, CCNT2, CCND1 GABRA1 4514/4885LMNA 832/4885GABRB2 4666/4885
US-20210147452-A1 TRIARYL PHOSPHINE LIGANDS, PREPARATION METHOD THEREFOR, AND USE IN CATALYSING COUPLING REACTIONS WEE1, WEE2, NOTUM GABRA1 751/4885LMNA 4759/4885GABRB2 1745/4885
US-11427553-B2 Dihydrooxadiazinones CCND2, CCNT2, CCND1 GABRA1 4514/4885LMNA 832/4885GABRB2 4666/4885

“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.