SCHEMBL6565919

SCHEMBL6565919

CC(CCCC=O)C1CCCC1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.35
TSHR P16473 2/20 0.34
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
EPHX1 P07099 1/20 0.31
SHBG P04278 1/20 0.31
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 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
SCHEMBL787828 0.98 GLA (0.36) HIF1ATSHRGLAHPGDEPHX1
SCHEMBL6565885 0.90 GLA (0.36) GLAHPGDEPHX1SHBGADH1B
SCHEMBL13658005 0.78 ADH1B (0.40) TSHRHPGDEPHX1SHBGADH1B
SCHEMBL791616 0.78 F2 (0.38) HIF1ATSHRGLAHPGD
SCHEMBL10699560 0.74 EPHX1 (0.34) HIF1AEPHX1SHBGADH1BADH1C
SCHEMBL134897 0.74 SHBG (0.41) SHBG
SCHEMBL25338157 0.74 SHBG (0.36) GLAHPGDEPHX1SHBGADH1B
SCHEMBL8022396 0.73 SHBG (0.37) EPHX1SHBG
SCHEMBL134684 0.72 SHBG (0.44) TSHREPHX1SHBG
SCHEMBL11449188 0.72 SHBG (0.39) GLAHPGDEPHX1SHBGADH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1147467-C Cyclopentyl alkyl cyanide ���ֵ���³����ʹ�˾ 2004-04-28 CN claimed
EP-1067118-B1 Cyclopentylalkyl-nitriles and the use of odoriferous cyclopentylalkyl derivatives as fragrances GIVAUDAN SA (CH) 2004-03-31 EP claimed
CN-1147467-C Cyclopentyl alkyl cyanide ���ֵ���³����ʹ�˾ 2004-04-28 CN disclosed
EP-1067118-B1 Cyclopentylalkyl-nitriles and the use of odoriferous cyclopentylalkyl derivatives as fragrances GIVAUDAN SA (CH) 2004-03-31 EP disclosed
US-6441052-B1 ALKANOL, ALDEHYDE, AND KETONE CYCLOPENTA DERIVATIVES; FRAGRANCES GIVAUDAN SA (CH) 2002-08-27 US disclosed
US-20020086901-A1 CYCLOPENTYLALKYL-NITRILES GIVAUDAN SA, A SWITZERLAND CORPORATION 2002-07-04 US disclosed
US-6410000-B1 PERFUME GIVAUDAN SA (CH) 2002-06-25 US disclosed
US-6399811-B1 ORGANOLEPTIC GIVAUDAN SA (CH) 2002-06-04 US disclosed
CN-1290691-A Cyclopentyl alkyl cyanide GIVAUDAN ROURE INTERNAT SA (CH) 2001-04-11 CN disclosed
EP-1067118-A1 Cyclopentylalkyl-nitriles and the use of odoriferous cyclopentylalkyl derivatives as fragrances Givaudan SA (CH) 2001-01-10 EP 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-20020086901-A1 CYCLOPENTYLALKYL-NITRILES CCRL2, CBR1, CNR1 HIF1A 805/4885TSHR 4054/4885GLA 3784/4885

“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.