SCHEMBL1967807

SCHEMBL1967807

COC(=O)C(NCCCCO)c1ccc(O)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
CNR1 P21554 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MIF P14174 2/20 0.41
POLB P06746 1/20 0.39
TACR3 P29371 1/20 0.37
RRM1 P23921 1/20 0.37
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 0.36
CYP4A11 Q02928 1/20 0.36
FOLH1 Q04609 1/20 0.35

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
SCHEMBL1968165 0.89 ESR1 (0.50) ALDH1A1LMNAHSD17B10ESR1ESR2
SCHEMBL705659 0.84 SMN1; SMN2 (0.45) ALDH1A1LMNAHSD17B10SMN1; SMN2MEN1
SCHEMBL1969740 0.83 ESR1 (0.50) ALDH1A1LMNAESR1ESR2SMN1; SMN2
SCHEMBL1967355 0.82 ALDH1A1 (0.47) ALDH1A1ESR1ESR2SMN1; SMN2MEN1
SCHEMBL1969471 0.79 ESR1 (0.47) ESR1ESR2SMN1; SMN2MEN1KMT2A
SCHEMBL1972977 0.78 ESR1 (0.46) ALDH1A1ESR1ESR2SMN1; SMN2MEN1
SCHEMBL1967839 0.77 SMN1; SMN2 (0.45) ALDH1A1ESR1ESR2SMN1; SMN2MEN1
SCHEMBL1967257 0.76 ESR1 (0.49) ESR1ESR2MEN1KMT2AMIF
SCHEMBL1968294 0.76 ESR1 (0.49) ESR1ESR2MEN1KMT2AMIF
SCHEMBL1968316 0.75 ESR1 (0.48) ESR1ESR2SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8168667-B2 Imidazolidine derivatives, uses therefor, preparation thereof and compositions comprising such GALAPAGOS NV (BE) 2012-05-01 US disclosed
EP-2026799-B1 IMIDAZOLIDINE DERIVATIVES, USES THEREFOR, PREPARATION THEREOF AND COMPOSITIONS COMPRISING SUCH GALAPAGOS SAS (FR) 2011-06-22 EP disclosed
US-20100210699-A1 IMIDAZOLIDINE DERIVATIVES, USES THEREFOR, PREPARATION THEREOF AND COMPOSITIONS COMPRISING SUCH DART THERAPUTICS, LLC. 2010-08-19 US disclosed
US-20100063120-A1 Imidazolidine Derivatives, Uses Therefor, Preparation Thereof and Compositions Comprising Such SASU, GALAPAGOS (FR) 2010-03-11 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-20100210699-A1 IMIDAZOLIDINE DERIVATIVES, USES THEREFOR, PREPARATION THEREOF AND COMPOSITIONS COMPRISING SUCH NR5A1, AR, HSD17B7 ALDH1A1 300/4885LMNA 4085/4885HSD17B10 104/4885
US-20100063120-A1 Imidazolidine Derivatives, Uses Therefor, Preparation Thereof and Compositions Comprising Such NR5A1, AR, HSD17B7 ALDH1A1 290/4885LMNA 4071/4885HSD17B10 101/4885

“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.