SCHEMBL290561

SCHEMBL290561

COCCCOS(C)(=O)=O

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.70
TSHR P16473 2/20 0.70
ALDH1A1 P00352 2/20 0.70
KDM4E B2RXH2 1/20 0.70
LMNA P02545 1/20 0.70
MMP9 P14780 1/20 0.70
ALOX15 P16050 1/20 0.70
CA1 P00915 16/20 0.36
CA2 P00918 16/20 0.36
CA9 Q16790 14/20 0.36
CA12 O43570 5/20 0.35
CA7 P43166 5/20 0.35
CA14 Q9ULX7 5/20 0.35
CA3 P07451 4/20 0.35
CA4 P22748 4/20 0.35
CA6 P23280 4/20 0.35
CA5A P35218 4/20 0.35
CA5B Q9Y2D0 4/20 0.35
MAPK1 P28482 1/20 0.33

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
SCHEMBL921986 0.95 TSHR (0.79) USP2TSHRALDH1A1KDM4ELMNA
SCHEMBL6622075 0.93 USP2 (0.61) USP2TSHRALDH1A1KDM4ELMNA
SCHEMBL920792 0.92 TSHR (0.75) USP2TSHRALDH1A1KDM4ELMNA
SCHEMBL922498 0.92 TSHR (0.75) USP2TSHRALDH1A1KDM4ELMNA
SCHEMBL1109868 0.92 TSHR (0.75) USP2TSHRALDH1A1KDM4ELMNA
SCHEMBL576408 0.89 TSHR (0.88) USP2TSHRALDH1A1KDM4ELMNA
SCHEMBL10068323 0.86 TSHR (0.52) USP2TSHRALDH1A1KDM4ELMNA
SCHEMBL263556 0.83
Busulfan SCHEMBL4373 0.83 TSHR (1.00) USP2TSHRALDH1A1KDM4ELMNA
Busulfan SCHEMBL4764696 0.83 TSHR (1.00) USP2TSHRALDH1A1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011148392-A1 PROCESS FOR THE PREPARATION OF (2S,4S,5S,7S)-N-(2-CARBAMYL-2- METHYLPROPYL)-5-AMINO-4-HYDROXY-2,7-DIISOPROPYL-8-[4-METHOXY-3-(3- METHOXYPROPOXY)PHENYL]-OCTANAMIDE HEMIFUMARATE AND ITS INTERMEDIATES THEREOF MSN LABORATORIES LIMITED (IN) 2011-12-01 WO claimed
WO-2007117482-A2 RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. (US) 2007-10-18 WO claimed
CN-114539133-B Method for preparing prucalopride intermediate 1- (3-methoxypropyl) -4-piperidinamine 鲁南制药集团股份有限公司 2024-09-20 CN disclosed
US-12029708-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2024-07-09 US disclosed
US-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2023-07-13 US disclosed
US-20230025807-A1 CD38 INHIBITORS Astellas Engineered Small Molecules US, Incorporated 2023-01-26 US disclosed
CN-115197123-A Preparation method of prucalopride intermediate 1- (3-methoxypropyl) -4-piperidinamine 山东新时代药业有限公司 2022-10-18 CN disclosed
US-11446261-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2022-09-20 US disclosed
CN-115043773-A Synthesis method of 4-N-tert-butyloxycarbonyl-1- (3-methoxypropyl) -4-piperidinamine 山东新时代药业有限公司 2022-09-13 CN disclosed
CN-114591220-A Preparation method of prucalopride intermediate 1- (3-methoxypropyl) -4-piperidinamine 鲁南制药集团股份有限公司 2022-06-07 CN disclosed
CN-114539134-A Synthetic method of prucalopride intermediate 1- (3-methoxypropyl) -4-piperidinamine 鲁南制药集团股份有限公司 2022-05-27 CN disclosed
US-6969714-B2 Imidazolo-5-YL-2-anilino-pyrimidines as agents for the inhibition of the cell proliferation ASTRAZENECA AB (SE) 2005-11-29 US disclosed
US-6969712-B2 Benzimidazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-11-29 US disclosed
US-20050131000-A1 Derivatives of 4-(imidazol-5-yl)-2-(4-sulfoanilino)pyrimidine with cdk inhibitory activity ASTRAZENECA AB (SE) 2005-06-16 US disclosed
EP-1351958-B1 IMIDAZOLO-5-YL-2-ANILINO-PYRIMIDINES AS AGENTS FOR THE INHIBITION OF THE CELL PROLIFERATION ASTRAZENECA AB (SE) 2004-06-16 EP disclosed
US-20040044056-A1 Benzimidazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-03-04 US disclosed
US-20040014776-A1 Imidazolo-5-YL-2anilino-pyrimidines as agents for the inhibition of the cell proliffration ASTRAZENECA AB (SE) 2004-01-22 US disclosed
EP-1342717-A1 BENZIMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2003-09-10 EP disclosed
CN-1377349-A Quinuclidine compound and medicine containing the same as active ingredient EISAI CO LTD (JP) 2002-10-30 CN disclosed
US-6187780-B1 ANTIDEPRESSANTS, ANTIASTHMATIC AGENTS; MIGRAINE BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-02-13 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 (7 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-12029708-B2 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER USP2 3553/4885TSHR 2964/4885ALDH1A1 140/4885
US-20230025807-A1 CD38 INHIBITORS CD38, GLS, IDH2 USP2 4492/4885TSHR 2701/4885ALDH1A1 140/4885
US-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER USP2 3473/4885TSHR 2971/4885ALDH1A1 133/4885
US-20050131000-A1 Derivatives of 4-(imidazol-5-yl)-2-(4-sulfoanilino)pyrimidine with cdk inhibitory activity CCNI, CDK2, CDK1 USP2 2650/4885TSHR 3691/4885ALDH1A1 1079/4885
US-20040014776-A1 Imidazolo-5-YL-2anilino-pyrimidines as agents for the inhibition of the cell proliffration CCNI, TYMP, MKI67 USP2 2437/4885TSHR 2543/4885ALDH1A1 545/4885
US-11446261-B2 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER USP2 3553/4885TSHR 2964/4885ALDH1A1 140/4885
US-20040044056-A1 Benzimidazole derivatives GPR119, OPRL1, INSR USP2 4219/4885TSHR 239/4885ALDH1A1 1851/4885

“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.