SCHEMBL63699

SCHEMBL63699

COC(=O)c1ccccc1I

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.61
LMNA P02545 2/20 0.61
HSD17B10 Q99714 2/20 0.59
ALDH1A1 P00352 2/20 0.59
CFTR P13569 1/20 0.59
KDM4E B2RXH2 2/20 0.57
POLB P06746 1/20 0.57
ATM Q13315 1/20 0.57
MAPT P10636 2/20 0.52
KMT2A Q03164 2/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA5A P35218 1/20 0.52
CA9 Q16790 1/20 0.52
ALOX15 P16050 1/20 0.52
PTPRF P10586 1/20 0.51
PTPN2 P17706 1/20 0.51
PTPN1 P18031 1/20 0.51
SLC6A3 Q01959 3/20 0.50
TDP1 Q9NUW8 2/20 0.50

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
Ammonia Solution, Strong SCHEMBL28953721 0.98 TSHR (0.59) TSHRLMNAHSD17B10ALDH1A1CFTR
Benzene SCHEMBL28449714 0.98 TSHR (0.59) TSHRLMNAHSD17B10ALDH1A1CFTR
Fluoride SCHEMBL28310481 0.98 TSHR (0.59) TSHRLMNAHSD17B10ALDH1A1CFTR
SCHEMBL29058049 0.89 TSHR (0.50) TSHRLMNAHSD17B10ALDH1A1CFTR
SCHEMBL8589676 0.89 CA1 (0.51) TSHRLMNAHSD17B10ALDH1A1CFTR
SCHEMBL28841525 0.85 SLC6A3 (0.51) TSHRLMNAHSD17B10ALDH1A1CFTR
SCHEMBL15528435 0.84 TSHR (0.69) TSHRLMNAHSD17B10ALDH1A1KDM4E
Dimethyl Phthalate SCHEMBL790124 0.84 TSHR (0.74) TSHRLMNAHSD17B10ALDH1A1CFTR
Dimethyl Phthalate SCHEMBL29500970 0.84 TSHR (0.74) TSHRLMNAHSD17B10ALDH1A1CFTR
Dimethyl Phthalate SCHEMBL34630 0.84 TSHR (0.74) TSHRLMNAHSD17B10ALDH1A1CFTR

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 1461 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119930688-A Tetrazazole tridentate chiral N, N, P-ligand (Zhang Yufeng type chiral anion ligand) derived from cinchona alkaloid, and preparation method and application thereof 南方科技大学 2025-05-06 CN claimed
CN-119776812-A Chemical nickel-palladium ion plating activating solution for copper pads of display panel and preparation method thereof 湖北兴福电子材料股份有限公司 2025-04-08 CN claimed
CN-118459482-A Selenium-containing spiro compound and preparation method and application thereof 华南理工大学 2024-08-09 CN claimed
CN-113980117-B Fenpyroximate antigen and preparation method and application thereof 西南大学 2024-07-12 CN claimed
CN-117865925-A 3, 4-benzocoumarin compound based on complex functional aromatic hydrocarbon and preparation method and application thereof 上海瑞苷生物科技有限公司 2024-04-12 CN claimed
CN-117820460-A Methoxypiperidine ethyl antigen and preparation method and application thereof 西南大学 2024-04-05 CN claimed
CN-117003639-A Preparation method of methyl o-iodobenzoate 宿迁盛基医药科技有限公司 2023-11-07 CN claimed
CN-116789667-A Planar triarylamine molecule and synthesis method thereof 天津大学 2023-09-22 CN claimed
CN-115925683-A Dendritic carbazole pyridine formaldehyde compound, preparation method and application 郑州大学 2023-04-07 CN claimed
CN-112707906-B Novel organic electroluminescent material based on benzopyrrole diketone and application thereof 安徽秀朗新材料科技有限公司 2023-04-07 CN claimed
CN-102702097-A Preparation method of montelukast sodium intermediate UNIV ZHEJIANG 2012-10-03 CN claimed
CN-102321199-A Schiff base rare-earth catalyst, preparation method and application BEIJING INST TECHNOLOGY 2012-01-18 CN claimed
CN-102260223-A Serial-aristeromycin compounds containing 1,3-benzodiazole and synthesis method thereof 2011-11-30 CN claimed
US-20100298571-A1 ARYLAMINE SYNTHESIS METHOD CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2010-11-25 US claimed
WO-2010064109-A2 AN IMPROVED PROCESS FOR THE PREPARATION OF MONTELUKAST SODIUM AND ITS INTERMEDIATES MAYUKA LABS PRIVATE LIMITED (IN) 2010-06-10 WO claimed
EP-1399156-B1 ALKYLIDENE PIRAZOLIDINEDIONE DERIVATIVES AND THEIR USE FOR TREATING DIABETES AND OBESITY APPLIED RESEARCH SYSTEMS (AN) 2006-11-22 EP claimed
WO-2006021974-A1 A PROCESS FOR SYNTHESIZING DIOL (VIII)-AN INTERMEDIATE OF MONTELUKAST SODIUM MOREPEN LABORATORIES LIMITED (IN) 2006-03-02 WO claimed
US-20040220188-A1 Alkylidene pyrazolidinedione derivatives LABORATOIRES SERONO SA (CH) 2004-11-04 US claimed
EP-1399156-A2 ALKYLIDENE PIRAZOLIDINEDIONE DERIVATIVES AND THEIR USE FOR TREATING DIABETES AND OBESITY Applied Research Systems ARS Holding N.V. (AN) 2004-03-24 EP claimed
WO-2002102359-A2 ALKYLIDENE PYRAZOLIDINEDIONE DERIVATIVES AND USE FOR TREATING DIABETES AND OBESITY APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2002-12-27 WO claimed

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-20040220188-A1 Alkylidene pyrazolidinedione derivatives G6PC1, PPM1D, PTPRS TSHR 1160/4885LMNA 4876/4885HSD17B10 247/4885
US-20100298571-A1 ARYLAMINE SYNTHESIS METHOD NAT1, ASNS, AOC2 TSHR 1305/4885LMNA 2818/4885HSD17B10 967/4885

“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.