SCHEMBL21046033

SCHEMBL21046033

C=C(C)C(=O)NCC(CCCC)n1ccc(=O)c(OCc2ccccc2)c1C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ NPC1 O15118 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.40
▸ POLB P06746 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ CNR2 P34972 1/20 0.34
▸ PTGER1 P34995 1/20 0.34
▸ PTGER4 P35408 1/20 0.34
▸ PTGER3 P43115 1/20 0.34
▸ PTGER2 P43116 1/20 0.34
▸ PTGES O14684 1/20 0.34
▸ ALOX5 P09917 1/20 0.34

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
SCHEMBL21046036 0.91 HTT (0.47) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL21046037 0.85 HTT (0.48) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL30580521 0.78 HTT (0.52) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL19899411 0.75 HTT (0.59) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL30580528 0.74 HTT (0.54) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL30580525 0.73 MEN1 (0.59) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL30580526 0.73 MEN1 (0.59) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL21046032 0.72 HTT (0.40) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL29243825 0.72 MEN1 (0.56) HTTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL30580520 0.72 MEN1 (0.56) HTTSMN1; SMN2MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12024490-B2 Polymeric metal chelating compositions and methods of preparing same for controlling growth and activities of living cells and organisms for therapeutic use in treating diseases in animals, fish or humans CHELATION PARTNERS INCORPORATED (CA) 2024-07-02 — — US disclosed
US-20220002250-A1 POLYMERIC METAL CHELATING COMPOSITIONS AND METHODS OF PREPARING SAME FOR CONTROLLING GROWTH AND ACTIVITIES OF LIVING CELLS AND ORGANISMS FOR THERAPEUTIC USE IN TREATING DISEASES IN ANIMALS, FISH OR HUMANS JUBILANT CHEMSYS LTD. (IN) 2022-01-06 — — US disclosed
US-11059785-B2 Polymeric metal chelating compositions and methods of preparing same for controlling growth and activities of living cells and organisms CHELATION PARTNERS INCORPORATED (CA) 2021-07-13 — — US disclosed
US-20190169126-A1 POLYMERIC METAL CHELATING COMPOSITIONS AND METHODS OF PREPARING SAME FOR CONTROLLING GROWTH AND ACTIVITIES OF LIVING CELLS AND ORGANISMS CHELATION PARTNERS INCORPORATED (CA) 2019-06-06 — — 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 (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-20220002250-A1 POLYMERIC METAL CHELATING COMPOSITIONS AND METHODS OF PREPARING SAME FOR CONTROLLING GROWTH AND ACTIVITIES OF LIVING CELLS AND ORGANISMS FOR THERAPEUTIC USE IN TREATING DISEASES IN ANIMALS, FISH OR HUMANS TFRC, HMBS, PICALM HTT 1484/4885SMN1; SMN2 812/4885MEN1 2264/4885
US-12024490-B2 Polymeric metal chelating compositions and methods of preparing same for controlling growth and activities of living cells and organisms for therapeutic use in treating diseases in animals, fish or humans TFRC, HMBS, PICALM HTT 1484/4885SMN1; SMN2 812/4885MEN1 2264/4885
US-11059785-B2 Polymeric metal chelating compositions and methods of preparing same for controlling growth and activities of living cells and organisms PICALM, HMBS, TFRC HTT 3362/4885SMN1; SMN2 2683/4885MEN1 1739/4885
US-20190169126-A1 POLYMERIC METAL CHELATING COMPOSITIONS AND METHODS OF PREPARING SAME FOR CONTROLLING GROWTH AND ACTIVITIES OF LIVING CELLS AND ORGANISMS PICALM, HMBS, TFRC HTT 3362/4885SMN1; SMN2 2683/4885MEN1 1739/4885

“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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