SCHEMBL176115

SCHEMBL176115

C=CC(=O)NC(CCC)(C(=O)[O-])[N+](C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
BBOX1 O75936 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
SCHEMBL1309532 0.80 MEN1 (0.33) MEN1KMT2AALDH1A1
SCHEMBL1310807 0.78 ALDH1A1 (0.34) MEN1KMT2AALDH1A1
SCHEMBL463384 0.77 BBOX1 (0.33) BBOX1
SCHEMBL1312539 0.77 ALDH1A1 (0.41) MEN1KMT2AALDH1A1BBOX1
SCHEMBL19128769 0.75 PKM (0.30)
SCHEMBL1310785 0.74 ALDH1A1 (0.46) MEN1KMT2AALDH1A1MAPK1BBOX1
SCHEMBL1309574 0.73 ALDH1A1 (0.49) MEN1KMT2AALDH1A1MAPK1
SCHEMBL458992 0.72 ALDH1A1 (0.47) MEN1KMT2AALDH1A1MAPK1
SCHEMBL1310843 0.72 ALDH1A1 (0.47) MEN1KMT2AALDH1A1MAPK1
SCHEMBL420549 0.72 ALDH1A1 (0.47) MEN1KMT2AALDH1A1MAPK1

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 1439 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4256015-B1 A HARD SURFACE CLEANING COMPOSITION UNILEVER IP HOLDINGS B V (NL) 2024-07-10 EP claimed
CN-118302146-A Personal care compositions for cleansing skin 宝洁公司 2024-07-05 CN claimed
WO-2024144562-A1 CHLORINATED ALKALINE FOAMING CLEANING PRODUCT ECZACIBASI TUKETIM URUNLERI SANAYI VE TICARET ANONIM SIRKETI (TR) 2024-07-04 WO claimed
US-20240207154-A1 PERSONAL CLEANSING COMPOSITIONS, METHODS AND USES THE PROCTER & GAMBLE COMPANY 2024-06-27 US claimed
WO-2024129647-A1 PERSONAL CLEANSING COMPOSITIONS, METHODS AND USES THE PROCTER & GAMBLE COMPANY (US) 2024-06-20 WO claimed
EP-4196565-B1 LAUNDRY DETERGENT COMPOSITION UNILEVER IP HOLDINGS B V (NL) 2024-04-17 EP claimed
CN-117752977-A Compressed air foam fire extinguishing system and fire extinguishing medium suitable for transformer substation 国电南瑞科技股份有限公司 2024-03-26 CN claimed
US-11911496-B2 Lamellar and low sulfate and soap cleansing composition CONOPCO, INC. (US) 2024-02-27 US claimed
EP-4319712-A2 PERSONAL CLEANSING COMPOSITIONS, METHODS AND USES The Procter & Gamble Company (US) 2024-02-14 EP claimed
US-20240024215-A1 ANTI-DANDRUFF COMPOSITION COMPRISING PIROCTONE OLAMINE CONOPCO, INC., D/B/A UNILEVER (US) 2024-01-25 US claimed
EP-0820503-B1 IMPROVEMENTS RELATING TO LIGHT DUTY CLEANING UNILEVER PLC (GB) 1999-09-15 EP claimed
EP-0820503-A1 IMPROVEMENTS RELATING TO LIGHT DUTY CLEANING UNILEVER PLC (GB) 1998-01-28 EP claimed
US-5610125-A ALKYL POLYGLYCOSIDE AND AN ESTERIFIED POLYETHER CHESEBROUGH-PONDS USA CO., DIVISION OF CONOPCO, INC. (US) 1997-03-11 US claimed
WO-1996032464-A1 IMPROVEMENTS RELATING TO LIGHT DUTY CLEANING UNILEVER PLC (GB) 1996-10-17 WO claimed
EP-0400976-B1 Shampoo composition UNILEVER PLC (GB) 1994-01-05 EP claimed
EP-0432951-B1 Hair treatment composition UNILEVER PLC (GB) 1993-10-20 EP claimed
US-5152914-A Surfactant; insoluble, nonvolatile silicone; suspending agent; optionally, cationic conditioner CHESEBROUGH-POND'S USA CO., DIVISION OF CONOPCO, INC. (US) 1992-10-06 US claimed
US-5085857-A Conditioning shampoo comprising a surfactant, a non-volatile silicone oil and guar hydroxypropyltrimonium chloride as a cationic conditioning polymer CHESEBROUGH-POND'S USA CO. (US) 1992-02-04 US claimed
EP-0432951-A2 Hair treatment composition UNILEVER PLC (GB) 1991-06-19 EP claimed
EP-0400976-A1 Shampoo composition UNILEVER PLC (GB) 1990-12-05 EP claimed

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-20240207154-A1 PERSONAL CLEANSING COMPOSITIONS, METHODS AND USES CUTA, POLR1C, MSH2 ZDHHC20 121/4885ZDHHC2 139/4885MEN1 1288/4885
US-20240024215-A1 ANTI-DANDRUFF COMPOSITION COMPRISING PIROCTONE OLAMINE POLR1C, HDAC10, PLOD3 ZDHHC20 132/4885ZDHHC2 1753/4885MEN1 2990/4885

“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.