SCHEMBL110158

SCHEMBL110158

CC(C)CCC(=O)CC(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.52
ALDH1A1 P00352 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP2C19 P33261 1/20 0.43
CA2 P00918 1/20 0.42
ACHE P22303 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
TRPA1 O75762 1/20 0.35
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRB1 P18505 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA3 P34903 2/20 0.33
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33
GABRA4 P48169 2/20 0.33
GABRE P78334 2/20 0.33

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
SCHEMBL18161881 0.95 CA1 (0.48) CA1ALDH1A1TDP1CYP2C19CA2
SCHEMBL16791086 0.85 CA1 (0.44) CA1ALDH1A1TDP1CYP2C19CA2
SCHEMBL110531 0.85 CA1 (0.60) CA1ALDH1A1TDP1CA2TRPA1
SCHEMBL106845 0.84 CA1 (0.42) CA1ALDH1A1TDP1CYP2C19CA2
SCHEMBL15345276 0.84 ALDH1A1 (0.46) CA1ALDH1A1TDP1CYP2C19CA2
SCHEMBL14350722 0.82 CA1 (0.57) CA1ALDH1A1TDP1CA2TRPA1
SCHEMBL13817695 0.82 ALDH1A1 (0.40) CA1ALDH1A1TDP1CYP2C19CA2
SCHEMBL6064551 0.82 CA1 (0.46) CA1ALDH1A1TDP1CYP2C19CA2
SCHEMBL30643272 0.82 ALDH1A1 (0.40) CA1ALDH1A1TDP1CYP2C19CA2
SCHEMBL30122637 0.82 GABRP (0.50) CA1ALDH1A1TDP1CYP2C19GABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2463374-A2 Isolated alcohol dehydrogenase enzymes and uses thereof Bio Architecture Lab, Inc. (US) 2012-06-13 EP claimed
EP-2195440-A2 BIOFUEL PRODUCTION Bio Architecture Lab, Inc. (US) 2010-06-16 EP claimed
US-20090155873-A1 BIOFUEL PRODUCTION BIO ARCHITECTURE LAB, INC. (US) 2009-06-18 US claimed
US-20090139134-A1 BIOFUEL PRODUCTION BIO ARCHITECTURE LAB, INC. (US) 2009-06-04 US claimed
WO-2009046375-A2 BIOFUEL PRODUCTION BIO ARCHITECTURE LAB, INC. (US) 2009-04-09 WO claimed
WO-2009046370-A2 BIOFUEL PRODUCTION BIO ARCHITECTURE LAB, INC. (US) 2009-04-09 WO claimed
EP-3230463-B2 RAPID PRETREATMENT APALTA PATENTS OUE (EE) 2025-07-16 EP disclosed
US-20240425893-A1 RAPID PRETREATMENT Apalta Patents OÜ (EE) 2024-12-26 US disclosed
US-12054761-B2 Rapid pretreatment Apalta Patents OÜ (EE) 2024-08-06 US disclosed
US-20240066133-A1 THERAPEUTIC AGENTS AND CONJUGATES THEREOF AJ SCIENCES (YIXING) CO., LTD (CN) 2024-02-29 US disclosed
US-11834463-B2 High affinity macrocyclic FKB51-inhibitors for treatment of psychiatric disorders Technische Universität Darmstadt (DE) 2023-12-05 US disclosed
US-11821047-B2 High pressure zone formation for pretreatment Apalta Patent OÜ (EE) 2023-11-21 US disclosed
US-11802132-B2 Small molecules for inducing selective protein degradation and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-31 US disclosed
US-6447557-B1 HYDROCARBON OXYENATE WHICH IS SATURATED, ALIPHATIC MONOHYDRIC ALCOHOL, MONO- OR POLY-KETONE OR KETO-MONOHYDRIC ALIPHATIC ALCOHOL; ULTRA-LOW SULPHUR FUEL WITH REDUCED PARTICULATE EMISSIONS OVER A BROAD RANGE OF VEHICLES AND DRIVING CYCLES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2002-09-10 US disclosed
US-20020108299-A1 Diesel fuel composition EXXONMOBIL RESEARCH & ENGINEERING COMPANY 2002-08-15 US disclosed
US-20020104256-A1 Diesel fuel composition EXXONMOBIL RESEARCH & ENGINEERING COMPANY 2002-08-08 US disclosed
US-20020000063-A1 Diesel fuel composition EXXONMOBIL RESEARCH & ENGINEERING COMPANY 2002-01-03 US disclosed
WO-2001046349-A1 DIESEL FUEL COMPOSITION EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2001-06-28 WO disclosed
WO-2001046348-A1 DIESEL FUEL COMPOSITION EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2001-06-28 WO disclosed
WO-2001046346-A1 DIESEL FUEL COMPOSITION EXXONMOBIL RESEARCH ENGINEERING COMPANY (US) 2001-06-28 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 (4 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-11834463-B2 High affinity macrocyclic FKB51-inhibitors for treatment of psychiatric disorders FKBP1B, FKBP5, FKBP1A CA1 4776/4885ALDH1A1 4075/4885TDP1 3893/4885
US-20090139134-A1 BIOFUEL PRODUCTION MGAM, DCXR, MANBA CA1 2232/4885ALDH1A1 753/4885TDP1 2746/4885
US-11802132-B2 Small molecules for inducing selective protein degradation and uses thereof BAZ2A, BRD3, BRPF3 CA1 4565/4885ALDH1A1 4164/4885TDP1 3208/4885
US-20240066133-A1 THERAPEUTIC AGENTS AND CONJUGATES THEREOF TLR9, STING1, TLR3 CA1 3710/4885ALDH1A1 4469/4885TDP1 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.