Sugi Predict

Sugi Predict / Compounds / SCHEMBL3466658

SCHEMBL3466658

SCHEMBL3466658

CCc1cccc(C)c1N[C@@H](C)COC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.49
▸ NLRP3 Q96P20 1/20 0.43
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ PTGS2 P35354 1/20 0.40
▸ ALDH1A1 P00352 6/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ CYP2D6 P10635 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ POLB P06746 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ HTT P42858 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ RAB9A P51151 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
SCHEMBL3466659 1.00 KDM4E (0.49) KDM4ENLRP3MEN1KMT2AGAA
SCHEMBL5794071 1.00 KDM4E (0.49) KDM4ENLRP3MEN1KMT2AGAA
SCHEMBL30776762 1.00 KDM4E (0.49) KDM4ENLRP3MEN1KMT2AGAA
SCHEMBL11227410 0.90 MEN1 (0.44) KDM4ENLRP3MEN1KMT2AGAA
SCHEMBL6882581 0.87 KDM4E (0.45) KDM4EATMALDH1A1TDP1CYP2D6
SCHEMBL8012133 0.87 KDM4E (0.45) KDM4EATMALDH1A1TDP1CYP2D6
SCHEMBL4975113 0.87 KDM4E (0.45) KDM4EATMALDH1A1TDP1CYP2D6
SCHEMBL11434002 0.86 NLRP3 (0.45) KDM4ENLRP3MEN1KMT2APTGS2
SCHEMBL15423242 0.83 PTGS2 (0.44) KDM4ENLRP3MEN1KMT2AGAA
SCHEMBL16998575 0.83 PTGS2 (0.44) KDM4ENLRP3MEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115417777-B Preparation method of (S) -2-ethyl-N- (1-methoxy-2-propyl) -6-methylaniline 西安近代化学研究所 2024-08-02 — — CN claimed
CN-115417777-A Preparation method of (S) -2-ethyl-N- (1-methoxy-2-propyl) -6-methylaniline 西安近代化学研究所 2022-12-02 — — CN claimed
EP-3271325-B1 PROCESS OF PRODUCTION OF (S) -METOLACHLOR ASCENZA AGRO S A (PT) 2020-12-02 — — EP claimed
EP-2892877-B1 PROCESS FOR THE PREPARATION OF (S)-2-ETHYL-N-(1-METHOXYPROPAN -2-YL)-6-METHYL ANILINE COUNCIL SCIENT IND RES (IN) 2017-06-21 — — EP claimed
US-9199930-B2 Process for the preparation of (S)-2-ethyl-N-(1-methoxypropan-2-yl)-6-methyl aniline COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-12-01 — — US claimed
US-20150225340-A1 PROCESS FOR THE PREPARATION OF (S)-2-ETHYL-N-(1-METHOXYPROPAN -2-YL)-6-METHYL ANILINE COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-08-13 — — US claimed
EP-2892877-A1 PROCESS FOR THE PREPARATION OF (S)-2-ETHYL-N-(1-METHOXYPROPAN -2-YL)-6-METHYL ANILINE Council of Scientific and Industrial Research (IN) 2015-07-15 — — EP claimed
WO-2014037962-A1 PROCESS FOR THE PREPARATION OF (S)-2-ETHYL-N-(1-METHOXYPROPAN -2-YL)-6-METHYL ANILINE COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2014-03-13 — — WO claimed
CN-1409699-A Process for preparation of secondary and tertiary amines CELGRO (US) 2003-04-09 — — CN claimed
EP-1237844-A1 PROCESS FOR THE PREPARATION OF SECONDARY AND TERTIARY AMINES Celgro (US) 2002-09-11 — — EP claimed
WO-2001044162-A1 PROCESS FOR THE PREPARATION OF SECONDARY AND TERTIARY AMINES CELGRO (US) 2001-06-21 — — WO claimed
US-6107521-A Process for the preparation of secondary amines CELGRO (US) 2000-08-22 — — US claimed
US-20240327332-A1 Process for Producing NAA and (S)-NAA SYNGENTA CROP PROTECTION AG (CH) 2024-10-03 — — US disclosed
CN-115417777-B Preparation method of (S) -2-ethyl-N- (1-methoxy-2-propyl) -6-methylaniline 西安近代化学研究所 2024-08-02 — — CN disclosed
CN-115417777-B Preparation method of (S) -2-ethyl-N- (1-methoxy-2-propyl) -6-methylaniline 西安近代化学研究所 2024-08-02 — — CN disclosed
CN-115417777-B Preparation method of (S) -2-ethyl-N- (1-methoxy-2-propyl) -6-methylaniline 西安近代化学研究所 2024-08-02 — — CN disclosed
US-6107521-A Process for the preparation of secondary amines CELGRO (US) 2000-08-22 — — US disclosed
EP-0691949-B1 PROCESS FOR THE HYDROGENATION OF IMINES CIBA GEIGY AG (CH) 1998-10-14 — — EP disclosed
EP-0691949-A1 PROCESS FOR THE HYDROGENATION OF IMINES Novartis AG (CH) 1996-01-17 — — EP disclosed
WO-1995021151-A1 PROCESS FOR THE HYDROGENATION OF IMINES CIBA-GEIGY AG (CH) 1995-08-10 — — 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 (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-20150225340-A1 PROCESS FOR THE PREPARATION OF (S)-2-ETHYL-N-(1-METHOXYPROPAN -2-YL)-6-METHYL ANILINE AZI2, HTR2A, HTR1B KDM4E 205/4885NLRP3 3111/4885MEN1 1088/4885
US-20240327332-A1 Process for Producing NAA and (S)-NAA NAA50, NAAA, NAA15 KDM4E 4779/4885NLRP3 3173/4885MEN1 218/4885

“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.