SCHEMBL5972998

SCHEMBL5972998

CCC(=O)c1ccc(C(=O)C(C)(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.53
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ ATM Q13315 1/20 0.42
▸ HSD17B3 P37058 2/20 0.41
▸ RAB9A P51151 5/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ PGR P06401 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ AR P10275 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MLYCD O95822 2/20 0.39
▸ GSK3B P49841 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL8051337 0.83 SMN1; SMN2 (0.70) MAPTSMN1; SMN2L3MBTL1ATMHSD17B3
SCHEMBL10031827 0.83 PGR (0.47) SMN1; SMN2L3MBTL1ALDH1A1PGRAR
SCHEMBL20953597 0.83 PPARA (0.42) MAPTSMN1; SMN2L3MBTL1ATMKMT2A
SCHEMBL24242591 0.83 PPARA (0.42) MAPTSMN1; SMN2L3MBTL1ATMKMT2A
SCHEMBL10432594 0.81 NPC1 (0.39) MAPTSMN1; SMN2L3MBTL1HSD17B3RAB9A
SCHEMBL11828224 0.81 GSK3B (0.61) MAPTHSD17B3RAB9ANPC1ALDH1A1
SCHEMBL12518234 0.80 ACHE (0.45) MAPTSMN1; SMN2L3MBTL1ATMALDH1A1
SCHEMBL26054306 0.80 SMN1; SMN2 (0.60) MAPTSMN1; SMN2L3MBTL1ALDH1A1HPGD
Ethyne SCHEMBL8050785 0.79 SMN1; SMN2 (0.64) MAPTSMN1; SMN2L3MBTL1ATMHSD17B3
SCHEMBL965418 0.78 RAB9A (0.63) MAPTSMN1; SMN2L3MBTL1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3216820-A1 POLYARYLETHER KETONE IMIDE SULFONE ADHESIVES The Boeing Company (US) 2017-09-13 — — EP disclosed
EP-1212335-B1 GLUCOPYRANOSIDES CONJUGATES OF 2-(4-HYDROXY-PHENYL)-1- 4-(2-AMIN-1-YL-ETHOXY)-BENZYL]-1H-INDOL-5-OLS WYETH CORP (US) 2006-01-18 — — EP disclosed
US-6537971-B2 Useful as tissue selective estrogenic agents, for therapy and prophylaxis of cardiovascular disorders, for increasing cognition or treating or inhibiting dementias or Alzheimer's Disease WYETH 2003-03-25 — — US disclosed
US-20020142971-A1 Glucopyranosides conjugates of 2-(4-hydroxy-phenyl)-3-methyl-1-[4-(2-amin-1-yl-ethoxy)-benzyl]-1H-indol-5-ols AMERICAN HOME PRODUCTS CORPORATION 2002-10-03 — — US disclosed
EP-1212335-A1 GLUCOPYRANOSIDES CONJUGATES OF 2-(4-HYDROXY-PHENYL)-1- 4-(2-AMIN-1-YL-ETHOXY)-BENZYL]-1H-INDOL-5-OLS AMERICAN HOME PRODUCTS CORPORATION (US) 2002-06-12 — — EP disclosed
US-6380166-B1 USEFUL AS TISSUE ELECTIVE ESTROGENIC AGENTS, USED IN HORMONE REPLACEMENT THERAPY FOR BONE LOSS PREVENTION IN POST-MENOPAUSAL WOMEN AMERICAN HOME PRODUCTS CORPORATION 2002-04-30 — — US disclosed
WO-2001019839-A1 GLUCOPYRANOSIDES CONJUGATES OF 2-(4-HYDROXY-PHENYL)-1-[4-(2-AMIN-1-YL-ETHOXY)-BENZYL]-1H-INDOL-5-OLS AMERICAN HOME PRODUCTS CORPORATION (US) 2001-03-22 — — WO 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-20020142971-A1 Glucopyranosides conjugates of 2-(4-hydroxy-phenyl)-3-methyl-1-[4-(2-amin-1-yl-ethoxy)-benzyl]-1H-indol-5-ols SHBG, GPER1, SULT1E1 MAPT 4045/4885SMN1; SMN2 4138/4885L3MBTL1 2539/4885

“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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