SCHEMBL21596550

SCHEMBL21596550

CC(C)CCCC(C)CCO/C=C/c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
HTR2A P28223 3/20 0.36
CHRNA7 P36544 6/20 0.35
TDP1 Q9NUW8 1/20 0.35
TP53 P04637 2/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
BLM P54132 1/20 0.34
NPC1 O15118 1/20 0.34
MTOR P42345 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
MAPK1 P28482 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL21596552 1.00 LMNA (0.38) LMNAHTR2ACHRNA7TDP1TP53
SCHEMBL8057322 0.87 HTR2A (0.42) LMNAHTR2ACHRNA7TDP1TP53
SCHEMBL4905648 0.83 TP53 (0.39) LMNAHTR2ACHRNA7TDP1TP53
SCHEMBL8382100 0.83 TP53 (0.39) LMNAHTR2ACHRNA7TDP1TP53
SCHEMBL21596607 0.78 ALOX15 (0.47) TDP1
SCHEMBL21596606 0.78 ALOX15 (0.47) TDP1
SCHEMBL24691226 0.76 LMNA (0.59) LMNATDP1
SCHEMBL24691968 0.76 LMNA (0.59) LMNATDP1
SCHEMBL13686299 0.74 MAOB (0.48) LMNACHRNA7MAPTSMN1; SMN2CYP2D6
SCHEMBL5670358 0.73 NPC1 (0.45) LMNAHTR2ACHRNA7TDP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257678-A1 ENOL ETHER PROPERFUME FIRMENICH SA (CH) 2023-08-17 US disclosed
EP-3746420-B1 ENOL ETHER PROPERFUME FIRMENICH & CIE (CH) 2023-08-16 EP disclosed
US-11667869-B2 Enol ether pro perfume FIRMENICH SA (CH) 2023-06-06 US disclosed
US-20210115354-A1 ENOL ETHER PROPERFUME FIRMENICH SA (CH) 2021-04-22 US disclosed
EP-3746420-A1 ENOL ETHER PROPERFUME Firmenich SA (CH) 2020-12-09 EP disclosed
WO-2019243501-A1 ENOL ETHER PROPERFUME FIRMENICH SA (CH) 2019-12-26 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 (3 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-11667869-B2 Enol ether pro perfume CYP2E1, ACADM, PEF1 LMNA 268/4885HTR2A 3462/4885CHRNA7 2432/4885
US-20230257678-A1 ENOL ETHER PROPERFUME CYP2E1, ADH5, ECI1 LMNA 1878/4885HTR2A 4154/4885CHRNA7 2343/4885
US-20210115354-A1 ENOL ETHER PROPERFUME CYP2E1, ACADM, ALDH5A1 LMNA 776/4885HTR2A 4145/4885CHRNA7 3366/4885

“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.