SCHEMBL979463

SCHEMBL979463

CC(=O)C(=Cc1ccccc1)C(C)=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.67
GLA P06280 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
POLB P06746 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
KDM4E B2RXH2 2/20 0.65
AKR1C3 P42330 1/20 0.61
HTT P42858 1/20 0.60
MAPT P10636 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
KMT2A Q03164 2/20 0.57
RECQL P46063 1/20 0.57
MEN1 O00255 1/20 0.57
TSHR P16473 1/20 0.56
LMNA P02545 1/20 0.54
GAA P10253 1/20 0.54
GLO1 Q04760 1/20 0.53
TP53 P04637 1/20 0.52
CA1 P00915 1/20 0.51
CA2 P00918 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
SCHEMBL28273258 0.95 AKR1C3 (0.61) ALDH1A1GLATDP1POLBL3MBTL1
SCHEMBL8440119 0.91 HTT (0.67) ALDH1A1GLATDP1POLBL3MBTL1
SCHEMBL2710798 0.91 HTT (0.67) ALDH1A1GLATDP1POLBL3MBTL1
SCHEMBL6583591 0.91 HTT (0.67) ALDH1A1GLATDP1POLBL3MBTL1
SCHEMBL9315389 0.87 ALDH1A1 (0.82) ALDH1A1GLATDP1POLBL3MBTL1
SCHEMBL10824895 0.87 AKR1C3 (0.53) ALDH1A1GLATDP1POLBL3MBTL1
SCHEMBL10824894 0.87 AKR1C3 (0.53) ALDH1A1GLATDP1POLBL3MBTL1
SCHEMBL11377680 0.87 AKR1C3 (0.53) ALDH1A1GLATDP1POLBL3MBTL1
SCHEMBL10824896 0.87 AKR1C3 (0.53) ALDH1A1GLATDP1POLBL3MBTL1
SCHEMBL11377632 0.87 AKR1C3 (0.53) ALDH1A1GLATDP1POLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106632100-B Preparation method of antibacterial veterinary drug quinocetone 杭州洪桥中科基因技术有限公司 2020-01-31 CN claimed
CN-108358831-A A kind of polysubstituted carbazole derivates and preparation method thereof 山东师范大学 2018-08-03 CN claimed
EP-1778176-B1 COMPOSITION FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2012-07-25 EP claimed
US-20080275264-A1 PROCESS FOR THE PREPARATION OF HALOGENOALKYLDIALKYL CHLOROSILANE RHODIA CHIMIE (FR) 2008-11-06 US claimed
US-7413579-B2 Method for dyeing fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-08-19 US claimed
EP-1633761-B1 METHOD OF PREPARING HALOGENOALKYLDIALKYLCHLOROSILANE RHODIA CHIMIE SA (FR) 2008-05-07 EP claimed
EP-1909913-A1 METHOD FOR QUICKLY CONCEALING THE ROOTS OF HAIR THAT HAVE GROWN AFTER THE HAIR HAS BEEN DYED HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-04-16 EP claimed
US-7300472-B2 Agents for coloring fibers containing keratin HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-11-27 US claimed
US-20070185344-A1 Method of preparing halogenoalkyldialkyl chlorosilane RHODIA CHIMIE (FR) 2007-08-09 US claimed
EP-1789015-A1 METHOD FOR STYLISHLY CHANGING THE COLOR OF KERATINIC FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-05-30 EP claimed
EP-0873743-A2 Use of benzylidene-ketones for dyeing keratinous fibers Henkel Kommanditgesellschaft auf Aktien (DE) 1998-10-28 EP claimed
US-5583242-A VANADYL COMPLEXES BRISTOL-MYERS SQUIBB COMPANY (US) 1996-12-10 US claimed
US-5565491-A FOR TREATMENT OF DISEASES MARKED BY MALIGNANT PROLIFERATION OF B CELLS, SUCH AS LEUKEMIA AND LYMPHOMAS; ANTICARCINOGENIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 1996-10-15 US claimed
EP-0357403-B1 Substituted beta-diketones ORION YHTYMAE OY (FI) 1994-12-14 EP claimed
US-5288750-A Antiulcer agents for gastrointestinal disorders ORION-YHTYMA OY (FI) 1994-02-22 US claimed
WO-1990002724-A1 SUBSTITUTED β-DIKETONES Orion-Yhtymä Oy (FI) 1990-03-22 WO claimed
EP-0357403-A2 Substituted beta-diketones ORION-YHTYMÀ„ OY (FI) 1990-03-07 EP claimed
US-4703099-A CATALYTICALLY TRIMERIZING ISOCYANATES THE DOW CHEMICAL COMPANY (US) 1987-10-27 US claimed
US-4632989-A KETENE AMINAL-OLEFIN REACTION PRODUCT AS CATALYSTS THE DOW CHEMICAL COMPANY (US) 1986-12-30 US claimed
US-4536490-A REACTION PRODUCT OF KETENE-AMINAL AND UNSATURATED COMPOUND THE UPJOHN COMPANY (US) 1985-08-20 US 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-20070185344-A1 Method of preparing halogenoalkyldialkyl chlorosilane HACL2, UBE3C, MCCC2 ALDH1A1 777/4885GLA 4064/4885TDP1 4272/4885
US-20080275264-A1 PROCESS FOR THE PREPARATION OF HALOGENOALKYLDIALKYL CHLOROSILANE HDHD5, DDC, HACL2 ALDH1A1 428/4885GLA 4463/4885TDP1 4449/4885

“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.