SCHEMBL10200947

SCHEMBL10200947

COc1ccc(C(CN)CC(=O)O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABBR2 O75899 4/20 0.64
▸ GABBR1 Q9UBS5 4/20 0.64
▸ KMT2A Q03164 3/20 0.63
▸ LMNA P02545 2/20 0.63
▸ CYP2C9 P11712 2/20 0.63
▸ CYP3A4 P08684 1/20 0.63
▸ ADORA3 P0DMS8 1/20 0.63
▸ NFKB1 P19838 1/20 0.63
▸ DRD3 P35462 1/20 0.63
▸ BLM P54132 1/20 0.63
▸ CYP1A2 P05177 1/20 0.63
▸ CYP2D6 P10635 1/20 0.63
▸ CYP2C19 P33261 1/20 0.63
▸ MEN1 O00255 1/20 0.63
▸ THRB P10828 1/20 0.63
▸ TSHR P16473 1/20 0.63
▸ GAA P10253 1/20 0.61
▸ FFAR1 O14842 3/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ FNTA P49354 2/20 0.52

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
SCHEMBL2226074 0.90 L3MBTL1 (0.68) KMT2AFFAR1L3MBTL1FNTAFNTB
SCHEMBL4453571 0.85 FFAR1 (0.78) KMT2AGAAFFAR1L3MBTL1FNTA
SCHEMBL5340895 0.82 L3MBTL1 (0.59) KMT2AFFAR1L3MBTL1FNTAFNTB
SCHEMBL11079771 0.82 ALDH1A1 (0.54) CYP3A4CYP1A2CYP2D6CYP2C19TSHR
SCHEMBL21631926 0.81 GABBR2 (0.61) GABBR2GABBR1KMT2ALMNACYP2C9
SCHEMBL13940816 0.81 GABBR2 (0.70) GABBR2GABBR1KMT2ALMNACYP2C9
SCHEMBL18386267 0.81 GABBR2 (0.70) GABBR2GABBR1KMT2ALMNACYP2C9
SCHEMBL6484578 0.80 FFAR1 (0.66) KMT2ALMNACYP2C9CYP3A4CYP1A2
SCHEMBL11023933 0.80 FFAR1 (0.60) KMT2AGAAFFAR1L3MBTL1FNTA
SCHEMBL28854188 0.80 FFAR1 (0.59) KMT2AFFAR1L3MBTL1FNTAFNTB

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-219283790-U Continuous and efficient drying device for o/p-toluenesulfonamide 浙江嘉化新材料有限公司 2023-06-30 — — CN claimed
US-20250079447-A1 NEGATIVE ELECTRODE ACTIVE MATERIAL AND NEGATIVE ELECTRODE SHIN-ETSU CHEMICAL CO., LTD (JP) 2025-03-06 — — US disclosed
EP-4465384-A1 NEGATIVE ELECTRODE ACTIVE MATERIAL AND NEGATIVE ELECTRODE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-11-20 — — EP disclosed
CN-219283790-U Continuous and efficient drying device for o/p-toluenesulfonamide 浙江嘉化新材料有限公司 2023-06-30 — — CN disclosed
CN-219283790-U Continuous and efficient drying device for o/p-toluenesulfonamide 浙江嘉化新材料有限公司 2023-06-30 — — CN disclosed
CN-113226713-B Additive manufacturing system, method and medium for producing three-dimensional objects 惠普发展公司,有限责任合伙企业 2023-06-20 — — CN disclosed
CN-112442356-B ABX 3 Preparation method of type stable perovskite quantum dot 南京邮电大学 2022-10-14 — — CN disclosed
CN-110072904-B Composition comprising fibrous material and thermoplastic binder 汉高股份有限及两合公司 2022-05-24 — — CN disclosed
US-8569336-B2 Compounds for the treatment of inflammatory disorders TONG LING (US) 2013-10-29 — — US disclosed
US-8569336-B2 Compounds for the treatment of inflammatory disorders TONG LING (US) 2013-10-29 — — US disclosed
US-20120015926-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TONG LING (US) 2012-01-19 — — US disclosed
US-20120015926-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TONG LING (US) 2012-01-19 — — 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 (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-20120015926-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TNF, ADAMTS1, ADAMTS7 GABBR2 2870/4885GABBR1 3154/4885KMT2A 4253/4885

“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.

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