Sugi Predict

Sugi Predict / Compounds / SCHEMBL3970194

SCHEMBL3970194

SCHEMBL3970194

CCCC(=O)Nc1cccc(C(=O)CO)c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ F2R P25116 8/20 0.58
▸ HPGD P15428 2/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ KMT2A Q03164 2/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ MTNR1B P49286 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ PARP1 P09874 1/20 0.51
▸ PARP10 Q53GL7 1/20 0.51

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
SCHEMBL6579989 0.89 MEN1 (0.59) HPGDSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL6579757 0.89 MEN1 (0.59) HPGDSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL6580028 0.88 L3MBTL1 (0.68) HPGDSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL6272750 0.86 HPGD (0.74) F2RHPGDSMN1; SMN2KMT2AMEN1
SCHEMBL11221078 0.84 SMN1; SMN2 (0.64) F2RHPGDSMN1; SMN2KMT2AMEN1
SCHEMBL15945988 0.84 KDM4E (0.60) HPGDKMT2AMEN1ALDH1A1PARP1
SCHEMBL10975643 0.84 F2R (0.73) F2RHPGDMTNR1BALDH1A1MAPT
SCHEMBL11868341 0.83 F2R (0.59) F2RHPGDSMN1; SMN2KMT2AMEN1
SCHEMBL3362788 0.83 MEN1 (0.77) F2RHPGDSMN1; SMN2KMT2AMEN1
SCHEMBL6582663 0.81 MAPT (0.73) HPGDSMN1; SMN2ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1359889-B1 PRIMARY INTERMEDIATE FOR OXIDATIVE COLORATION OF HAIR P & G CLAIROL INC (US) 2006-12-20 — — EP claimed
US-20050091762-A1 Primary intermediate for oxidative coloration of hair THE PROCTER & GAMBLE COMPANY 2005-05-05 — — US claimed
EP-1359889-A4 PRIMARY INTERMEDIATE FOR OXIDATIVE COLORATION OF HAIR P & G CLAIROL INC (US) 2004-12-01 — — EP claimed
EP-1359889-A2 PRIMARY INTERMEDIATE FOR OXIDATIVE COLORATION OF HAIR P&G-Clairol, Inc. (US) 2003-11-12 — — EP claimed
US-20030056303-A1 Primary intermediate for oxidative coloration of hair CLAIROL INCORPORATED 2003-03-27 — — US claimed
WO-2002058630-A2 PRIMARY INTERMEDIATE FOR OXIDATIVE COLORATION OF HAIR P&G-CLAIROL, INC. (US) 2002-08-01 — — WO claimed
CN-102241603-A Asymmetric synthesis method of R-or S-acebutolol CHINESE ACAD TECH INST PHYSICS 2011-11-16 — — CN disclosed
EP-1359890-A4 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P & G CLAIROL INC (US) 2009-08-12 — — EP disclosed
EP-1359889-B1 PRIMARY INTERMEDIATE FOR OXIDATIVE COLORATION OF HAIR P & G CLAIROL INC (US) 2006-12-20 — — EP disclosed
US-20060260072-A1 Primary intermediate for oxidative coloration of hair THE PROCTER & GAMBLE COMPANY 2006-11-23 — — US disclosed
EP-1359891-B1 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P & G CLAIROL INC (US) 2006-03-15 — — EP disclosed
US-20050091762-A1 Primary intermediate for oxidative coloration of hair THE PROCTER & GAMBLE COMPANY 2005-05-05 — — US disclosed
US-6838561-B2 Primary intermediates for oxidative coloration of hair THE PROCTER & GAMBLE COMPANY (US) 2005-01-04 — — US disclosed
US-20030056303-A1 Primary intermediate for oxidative coloration of hair CLAIROL INCORPORATED 2003-03-27 — — US disclosed
US-20020157192-A1 Primary intermediates for oxidative coloration of hair WELLA OPERATIONS US, LLC 2002-10-31 — — US disclosed
US-20020144358-A1 Primary intermediates for oxidative coloration of hair WELLA OPERATIONS US, LLC 2002-10-10 — — US disclosed
WO-2002062308-A2 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P&G-CLAIROL, INC. (US) 2002-08-15 — — WO disclosed
WO-2002058631-A2 PRIMARY INTERMEDIATES FOR OXIDATIVE COLORATION OF HAIR P&G-CLAIROL, INC. (US) 2002-08-01 — — WO disclosed
WO-2002058630-A2 PRIMARY INTERMEDIATE FOR OXIDATIVE COLORATION OF HAIR P&G-CLAIROL, INC. (US) 2002-08-01 — — WO disclosed
US-4579970-A 1-(4'-alkylamido)-2'{1[n-(alkyl)imino]-ethyl}-phenoxy-3-alkylamino-2-propanols and use thereof OY STAR AB (FI) 1986-04-01 — — 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 (5 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-20020157192-A1 Primary intermediates for oxidative coloration of hair AOX1, CYC1, CBR1 F2R 3626/4885HPGD 317/4885SMN1; SMN2 4863/4885
US-20030056303-A1 Primary intermediate for oxidative coloration of hair COXFA4L2, COX5A, COX5B F2R 4231/4885HPGD 159/4885SMN1; SMN2 4829/4885
US-20060260072-A1 Primary intermediate for oxidative coloration of hair COXFA4L2, COX5A, COX5B F2R 4189/4885HPGD 170/4885SMN1; SMN2 4844/4885
US-20020144358-A1 Primary intermediates for oxidative coloration of hair COX5A, CYC1, MT-CO1 F2R 4164/4885HPGD 290/4885SMN1; SMN2 4826/4885
US-20050091762-A1 Primary intermediate for oxidative coloration of hair COXFA4L2, COX5A, COX5B F2R 4231/4885HPGD 159/4885SMN1; SMN2 4829/4885

“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.