SCHEMBL2319965

SCHEMBL2319965

C=CC(c1ccccc1)C(C=O)CC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.43
CYP2C19 P33261 1/20 0.36
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 5/20 0.33
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
HSD17B10 Q99714 3/20 0.33
CYP3A4 P08684 3/20 0.33
ALOX15 P16050 3/20 0.33
MIF P14174 1/20 0.33
HTR2A P28223 1/20 0.32
HRH1 P35367 1/20 0.32
CYP2D6 P10635 1/20 0.32
HPGD P15428 3/20 0.32
USP2 O75604 2/20 0.32
TP53 P04637 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
ALOX12 P18054 1/20 0.32

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
SCHEMBL2319798 0.77 LMNA (0.47) LMNACYP2C19MEN1KMT2AMAPT
SCHEMBL1507251 0.76 LMNA (0.46) LMNACYP2C19MEN1KMT2APOLB
SCHEMBL3388678 0.76 LMNA (0.46) LMNACYP2C19MEN1KMT2AMAPT
SCHEMBL28655746 0.76 LMNA (0.42) LMNAMEN1KMT2APOLBMIF
SCHEMBL19292352 0.73 LMNA (0.48) LMNACYP2C19MAPTKDM4EALDH1A1
SCHEMBL9804092 0.73 LMNA (0.41) LMNACYP2C19MEN1KMT2APOLB
SCHEMBL2369067 0.72 LMNA (0.42) LMNAMEN1KMT2APOLBCYP2D6
SCHEMBL9686999 0.71 LMNA (0.40) LMNACYP2C19MEN1KMT2AMAPT
SCHEMBL16124230 0.70 LMNA (0.50) LMNACYP2C19MEN1KMT2AKDM4E
SCHEMBL7100519 0.70 LMNA (0.50) LMNACYP2C19MEN1KMT2AKDM4E

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-102202740-B Perfuming ingredients of the floral and/or anisic type FIRMENICH & CIE 2014-03-26 CN disclosed
US-8268895-B2 Perfuming ingredients of the floral and/or anis type FIRMENICH SA (CH) 2012-09-18 US disclosed
US-8268895-B2 Perfuming ingredients of the floral and/or anis type FIRMENICH SA (CH) 2012-09-18 US disclosed
US-8268895-B2 Perfuming ingredients of the floral and/or anis type FIRMENICH SA (CH) 2012-09-18 US disclosed
CN-102202740-A Perfuming ingredients of the floral and/or anisic type FIRMENICH & CIE 2011-09-28 CN disclosed
US-20110229426-A1 PERFUMING INGREDIENTS OF THE FLORAL AND/OR ANIS TYPE FIRMENICH SA (CH) 2011-09-22 US disclosed
US-20110229426-A1 PERFUMING INGREDIENTS OF THE FLORAL AND/OR ANIS TYPE FIRMENICH SA (CH) 2011-09-22 US disclosed
US-20110229426-A1 PERFUMING INGREDIENTS OF THE FLORAL AND/OR ANIS TYPE FIRMENICH SA (CH) 2011-09-22 US disclosed
EP-2352560-A1 PERFUMING INGREDIENTS OF THE FLORAL AND/OR ANIS TYPE Firmenich S.A. (CH) 2011-08-10 EP disclosed
WO-2010052636-A1 PERFUMING INGREDIENTS OF THE FLORAL AND/OR ANIS TYPE FIRMENICH SA (CH) 2010-05-14 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 (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-20110229426-A1 PERFUMING INGREDIENTS OF THE FLORAL AND/OR ANIS TYPE OPRM1, CCR4, RCOR1 LMNA 4253/4885CYP2C19 1691/4885MEN1 4485/4885

“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.