SCHEMBL9294353

SCHEMBL9294353

CC(C)CCCCCOP(OCCCCCC(C)C)Oc1ccc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.33
▸ RECQL P46063 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ SCN10A Q9Y5Y9 1/20 0.32
▸ GAA P10253 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL750445 1.00 ATM (0.34) ATMKDM4ERECQLL3MBTL1SCN10A
SCHEMBL28349706 0.89 ATM (0.33) ATMKDM4ERECQLL3MBTL1SCN10A
SCHEMBL11260156 0.88 L3MBTL1 (0.34) ATMKDM4ERECQLL3MBTL1SCN10A
SCHEMBL28349818 0.88 L3MBTL1 (0.34) ATMKDM4ERECQLL3MBTL1SCN10A
SCHEMBL2183919 0.86 THRA (0.40) KDM4ERECQLGAASMN1; SMN2MAPT
SCHEMBL11213999 0.86 THRA (0.40) KDM4ERECQLGAASMN1; SMN2MAPT
SCHEMBL11261607 0.84 MAPK1 (0.45) ATMSMN1; SMN2MAPTMAPK1NPSR1
SCHEMBL97771 0.83 THRA (0.40) KDM4ERECQLGAASMN1; SMN2MAPT
SCHEMBL6905040 0.83 THRA (0.40) KDM4ERECQLGAASMN1; SMN2MAPT
SCHEMBL466235 0.83 THRA (0.40) KDM4ERECQLGAASMN1; SMN2MAPT

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-5290747-A Nylon 6 catalyst system INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1994-03-01 — — US claimed
US-5298594-A Charging caprolactam, water and alkali metal hypophosphite catalyst, purging air, heating to form prepolymer, charging prepolymer with cocatalyst, heating by raising temperature CHINESE PETROCHEMICAL DEVELOPMENT CORP. (TW) 1994-03-29 — — US disclosed
US-5298598-A Preparation of polyamide with mixture of phosphorus catalysts INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1994-03-29 — — US disclosed
US-5290747-A Nylon 6 catalyst system INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1994-03-01 — — US disclosed
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