SCHEMBL2334583

SCHEMBL2334583

Nc1ncc(CC(=O)O)cn1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 4/20 0.62
GABRB2 P47870 4/20 0.62
GABRA1 P14867 3/20 0.62
GABRA4 P48169 3/20 0.62
GABRP O00591 2/20 0.62
GABRD O14764 2/20 0.62
GABRB1 P18505 2/20 0.62
GABRG2 P18507 2/20 0.62
GABRB3 P28472 2/20 0.62
GABRA3 P34903 2/20 0.62
GABRA2 P47869 2/20 0.62
GABRE P78334 2/20 0.62
GABRA6 Q16445 2/20 0.62
GABRG1 Q8N1C3 2/20 0.62
GABRG3 Q99928 2/20 0.62
GABRQ Q9UN88 2/20 0.62
P4HTM Q9NXG6 2/20 0.52
CYP1A2 P05177 1/20 0.45
AKR1B1 P15121 1/20 0.44
NAPRT Q6XQN6 1/20 0.44

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
SCHEMBL7499590 0.79 GABRA1 (0.53) GABRA5GABRB2GABRA1GABRA4GABRP
SCHEMBL1648642 0.78 GABRP (0.58) GABRA5GABRB2GABRA1GABRA4GABRP
SCHEMBL7390689 0.78 P4HTM (0.55) GABRA5GABRB2GABRA1GABRA4GABRP
SCHEMBL7017455 0.77 GABRP (0.52) GABRA5GABRB2GABRA1GABRA4GABRP
SCHEMBL1404488 0.77 GABRA1 (0.52) GABRA5GABRB2GABRA1GABRA4GABRP
SCHEMBL23286878 0.77 GABRA1 (0.52) GABRA5GABRB2GABRA1GABRA4GABRP
SCHEMBL2648712 0.77 GABRP (1.00) GABRA5GABRB2GABRA1GABRA4GABRP
SCHEMBL14107961 0.75 CDK2 (0.53) GABRA5GABRB2GABRA1GABRA4GABRP
Hydrochloric Acid SCHEMBL1712322 0.75 GABRP (0.96) GABRA5GABRB2GABRA1GABRA4GABRP
SCHEMBL12304432 0.74 GABRP (0.48) GABRA5GABRB2GABRA1GABRA4GABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117343556-A Bio-based compound modified cracking carbon black and application thereof in tire preparation 中策橡胶集团股份有限公司 2024-01-05 CN claimed
CN-117247639-A Tire inner liner rubber composition containing bio-based modified cracking carbon black, mixing method and tire 中策橡胶集团股份有限公司 2023-12-19 CN claimed
CN-117247608-A Tire pad rubber composition containing bio-based modified cracking carbon black, mixing method and tire 中策橡胶集团股份有限公司 2023-12-19 CN claimed
CN-117343556-A Bio-based compound modified cracking carbon black and application thereof in tire preparation 中策橡胶集团股份有限公司 2024-01-05 CN disclosed
CN-117247608-A Tire pad rubber composition containing bio-based modified cracking carbon black, mixing method and tire 中策橡胶集团股份有限公司 2023-12-19 CN disclosed
CN-117247639-A Tire inner liner rubber composition containing bio-based modified cracking carbon black, mixing method and tire 中策橡胶集团股份有限公司 2023-12-19 CN disclosed
CN-112778212-B Synthesis method of cropanisin intermediate 2-aminopyrimidine-5-methyl carboxylate 苏州莱克施德药业有限公司 2022-03-15 CN disclosed
CN-112778212-B Synthesis method of cropanisin intermediate 2-aminopyrimidine-5-methyl carboxylate 苏州莱克施德药业有限公司 2022-03-15 CN disclosed
CN-112778212-B Synthesis method of cropanisin intermediate 2-aminopyrimidine-5-methyl carboxylate 苏州莱克施德药业有限公司 2022-03-15 CN disclosed
CN-112778212-A Synthesis method of cropanisin intermediate 2-aminopyrimidine-5-methyl carboxylate 苏州莱克施德药业有限公司 2021-05-11 CN disclosed
CN-112778212-A Synthesis method of cropanisin intermediate 2-aminopyrimidine-5-methyl carboxylate 苏州莱克施德药业有限公司 2021-05-11 CN disclosed
EP-1664032-A1 N-SUBSTITUTED PYRAZOLYL-AMIDYL-BENZIMIDAZOLYL C-KIT INHIBITORS OSI Pharmaceuticals, Inc. (US) 2006-06-07 EP disclosed
US-20060116402-A1 N-substituted benzimidazolyl c-Kit inhibitors and combinatorial benzimidazole library OSI PHARMACEUTICALS, INC. 2006-06-01 US disclosed
EP-1658289-A2 3-SUBSTITUTED IMIDAZOPYRIDINE-DERIVATIVES AS C-KIT INHIBITORS OSI Pharmaceuticals, Inc. (US) 2006-05-24 EP disclosed
US-20060035951-A1 N-substituted pyrazolyl-amidyl-benzimidazolyl c-Kit inhibitors BOLGER JOSHUA 2006-02-16 US disclosed
US-20060035921-A1 N3-substituted imidazopyridine c-Kit inhibitors CASTELHANO ARLINDO L 2006-02-16 US disclosed
WO-2005021544-A2 N3-SUBSTITUTED IMIDAZOPYRIDINE-DERIVATIVES AS C-KIT INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2005-03-10 WO disclosed
WO-2005021537-A1 N-SUBSTITUTED PYRAZOLYL-AMIDYL-BENZIMIDAZOLYL C-KIT INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2005-03-10 WO disclosed
WO-2005021531-A1 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2005-03-10 WO disclosed
US-6329383-B1 THESE COMPOUNDS ARE USEFUL AS A HUMAN GROWTH HORMONE (HGH) MIMETIC, WHICH TRIGGER GH AGONIST EFFECTS IN ANIMALS AND ESPECIALLY AS AN ORALLY AVAILABLE HUMAN GROWTH HORMONE (HGH). PHARMACIA AB (SE) 2001-12-11 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 (3 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-20060035921-A1 N3-substituted imidazopyridine c-Kit inhibitors KIT, ABL1, CHUK GABRA5 3064/4885GABRB2 2848/4885GABRA1 3329/4885
US-20060116402-A1 N-substituted benzimidazolyl c-Kit inhibitors and combinatorial benzimidazole library KIT, CHUK, TNNI3K GABRA5 3033/4885GABRB2 1678/4885GABRA1 2772/4885
US-20060035951-A1 N-substituted pyrazolyl-amidyl-benzimidazolyl c-Kit inhibitors KIT, TNNI3K, CHUK GABRA5 3140/4885GABRB2 2401/4885GABRA1 3141/4885

“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.