Pentanal

Pentanal

SCHEMBL622584

CCCCC=O.CCCCC=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 1.00
FAAH O00519 2/20 0.65
TRPV1 Q8NER1 2/20 0.65
ALDH1A1 P00352 4/20 0.62
HIF1A Q16665 1/20 0.60
ADH1B P00325 3/20 0.48
ADH1A P07327 3/20 0.48
ADH7 P40394 3/20 0.48
ADH1C P00326 2/20 0.48
EPHX1 P07099 1/20 0.46
ADH4 P08319 1/20 0.46
TDP1 Q9NUW8 2/20 0.44
MAPK1 P28482 1/20 0.44
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
Pentanal SCHEMBL28721 1.00
Pentanal SCHEMBL11299036 0.97
Pentanal SCHEMBL1628430 0.97
Pentanal SCHEMBL7624050 0.97
Pentanal SCHEMBL24385 0.97
Pentanal SCHEMBL4430016 0.97
Pentanal SCHEMBL5172697 0.97
Pentanal SCHEMBL11434933 0.97
Pentanal SCHEMBL3801508 0.97
Pentanal SCHEMBL4581160 0.97

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
EP-3052147-A1 COMPOSITIONS COMPRISING POLYAMINE POLYMER COMPATIBLE PERFUME MATERIALS The Procter & Gamble Company (US) 2016-08-10 EP disclosed
EP-3052605-A1 COMPOSITIONS COMPRISING HYDROPHOBICALLY MODIFIED POLYAMINE POLYMER COMPATIBLE PERFUME MATERIALS The Procter & Gamble Company (US) 2016-08-10 EP disclosed
WO-2015050915-A1 COMPOSITIONS COMPRISING POLYAMINE POLYMER COMPATIBLE PERFUME MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2015-04-09 WO disclosed
WO-2015050916-A1 COMPOSITIONS COMPRISING HYDROPHOBICALLY MODIFIED POLYAMINE POLYMER COMPATIBLE PERFUME MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2015-04-09 WO disclosed
US-8779200-B2 Microwave induced single step green synthesis of some novel 2-aryl aldehydes and their analogues COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2014-07-15 US disclosed
EP-2642990-A1 THERAPEUTIC USE OF COMPOUNDS UCL Business Plc. (GB) 2013-10-02 EP disclosed
WO-2012069790-A1 THERAPEUTIC USE OF COMPOUNDS ROYAL HOLLOWAY AND BEDFORD NEW COLLEGE (GB) 2012-05-31 WO disclosed
US-20120041234-A1 MICROWAVE INDUCED SINGLE STEP GREEN SYNTHESIS OF SOME NOVEL 2-ARYL ALDEHYDES AND THEIR ANALOGUES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGISTRATION OF SOCIETIES ACT (ACT XXI OF 1860)) (IN) 2012-02-16 US disclosed
WO-2010097811-A4 MICROWAVE INDUCED SINGLE STEP GREEN SYNTHESIS OF SOME NOVEL 2-ARYL ALDEHYDES AND THEIR ANALOGUES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-11-04 WO disclosed
WO-2010097811-A1 MICROWAVE INDUCED SINGLE STEP GREEN SYNTHESIS OF SOME NOVEL 2-ARYL ALDEHYDES AND THEIR ANALOGUES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-09-02 WO disclosed
US-4400547-A LIGANDIZING REACTOR EFFLUENT TO PREVENT CATALYST LOSS THROUGH PLATING EASTMAN KODAK COMPANY (US) 1983-08-23 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 (1 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-20120041234-A1 MICROWAVE INDUCED SINGLE STEP GREEN SYNTHESIS OF SOME NOVEL 2-ARYL ALDEHYDES AND THEIR ANALOGUES AADAC, NAT1, CTRB1 TSHR 846/4885FAAH 361/4885TRPV1 1970/4885

“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.