SCHEMBL1783887

SCHEMBL1783887

CCCC(C)C(C)CCC=O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
TSHR P16473 4/20 0.43
METAP1 P53582 1/20 0.37
FAAH O00519 2/20 0.36
TRPV1 Q8NER1 2/20 0.36
TDP1 Q9NUW8 2/20 0.33
MAPK1 P28482 1/20 0.33
HIF1A Q16665 1/20 0.32
ADH1B P00325 2/20 0.31
ADH1A P07327 2/20 0.31
ADH7 P40394 2/20 0.31
ADH1C P00326 1/20 0.31
ADH4 P08319 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL1782481 0.85 TSHR (0.52) ALDH1A1TSHRMETAP1FAAHTRPV1
SCHEMBL1781742 0.85 TSHR (0.52) ALDH1A1TSHRFAAHTRPV1HIF1A
SCHEMBL1787215 0.84 ALDH1A1 (0.41) ALDH1A1TSHRFAAHTRPV1TDP1
SCHEMBL812757 0.83 TSHR (0.52) ALDH1A1TSHRFAAHTRPV1ADH1B
SCHEMBL9260346 0.81 ALDH1A1 (0.40) ALDH1A1TSHRFAAHTRPV1SMN1; SMN2
SCHEMBL233139 0.79
SCHEMBL14817185 0.79
SCHEMBL1783446 0.79 METAP1 (0.37) ALDH1A1TSHRMETAP1TDP1MAPK1
SCHEMBL1783577 0.78
Ethane SCHEMBL21143022 0.77 ALDH1A1 (0.46) ALDH1A1TSHRFAAHTRPV1TDP1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230406801-A1 PROCESSES TO IMPROVE CATALYTIC METAL ACCOUNTABILITY IN HYDROFORMYLATION PROCESSES DOW TECHNOLOGY INVESTMENTS LLC (US) 2023-12-21 US disclosed
EP-4259598-A1 PROCESSES TO IMPROVE CATALYTIC METAL ACCOUNTABILITY IN HYDROFORMYLATION PROCESSES Dow Technology Investments LLC (US) 2023-10-18 EP disclosed
CN-116635362-A Method for improving the metering of catalytic metals in hydroformylation processes 陶氏技术投资有限责任公司 2023-08-22 CN disclosed
WO-2022132372-A1 PROCESSES TO IMPROVE CATALYTIC METAL ACCOUNTABILITY IN HYDROFORMYLATION PROCESSES DOW TECHNOLOGY INVESTMENTS LLC (US) 2022-06-23 WO disclosed
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
US-7186782-B2 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2007-03-06 US disclosed
US-20060041079-A1 Hydrogenation catalyst composition and process for hydrogenation of conjugated diene polymer TSRC CORPORATION 2006-02-23 US disclosed
US-6881797-B2 Process for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2005-04-19 US disclosed
US-20040082727-A1 Process for hydrogenation of conjugated diene polymer TSRC CORPORATION (CN) 2004-04-29 US disclosed
US-5998635-A CATALYTIC CYCLIZATION AN ALDEHYDE WITH A KETENE TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-12-07 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 (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-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TRPA1, HRH1, HRH2 ALDH1A1 520/4885TSHR 2479/4885METAP1 3904/4885
US-20230406801-A1 PROCESSES TO IMPROVE CATALYTIC METAL ACCOUNTABILITY IN HYDROFORMYLATION PROCESSES RTF1, PYM1, CYP4F11 ALDH1A1 2462/4885TSHR 2999/4885METAP1 3040/4885

“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.