SCHEMBL7602293

SCHEMBL7602293

CCC(Cc1ccccc1)=C(c1ccccc1)c1ccc(OCCN(CC)CC)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 12/20 0.65
EBP Q15125 6/20 0.65
SIGMAR1 Q99720 4/20 0.65
KMT2A Q03164 4/20 0.65
CYP2D6 P10635 4/20 0.65
MAPT P10636 4/20 0.65
KCNH2 Q12809 3/20 0.65
CHRM2 P08172 3/20 0.65
ADRA2A P08913 3/20 0.65
ADORA3 P0DMS8 3/20 0.65
CHRM1 P11229 3/20 0.65
PTGS1 P23219 3/20 0.65
SLC6A2 P23975 3/20 0.65
SLC6A4 P31645 3/20 0.65
DRD3 P35462 3/20 0.65
HTR6 P50406 3/20 0.65
SLC6A3 Q01959 3/20 0.65
MEN1 O00255 3/20 0.65
HTT P42858 2/20 0.65
EGFR P00533 2/20 0.65

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
SCHEMBL7597053 0.89 ESR1 (0.68) ESR1EBPSIGMAR1KMT2ACYP2D6
SCHEMBL7801089 0.86 ESR1 (0.67) ESR1EBPSIGMAR1KMT2ACYP2D6
SCHEMBL7704152 0.84 ESR1 (0.70) ESR1EBPSIGMAR1KMT2ACYP2D6
SCHEMBL7600262 0.84 ESR1 (0.61) ESR1EBPSIGMAR1KMT2ACYP2D6
SCHEMBL7600265 0.84 ESR1 (0.61) ESR1EBPSIGMAR1KMT2ACYP2D6
SCHEMBL7599819 0.84 EBP (0.74) ESR1EBPSIGMAR1KMT2ACYP2D6
SCHEMBL7599292 0.84 EBP (0.74) ESR1EBPSIGMAR1KMT2ACYP2D6
SCHEMBL7598606 0.83 ESR1 (0.60) ESR1EBPSIGMAR1KMT2ACYP2D6
SCHEMBL7602687 0.83 ESR1 (0.60) ESR1EBPSIGMAR1KMT2ACYP2D6
SCHEMBL7602691 0.83 ESR1 (0.60) ESR1EBPSIGMAR1KMT2ACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020161007-A1 Non-steroidal modulators of estrogen receptors PROVOST, FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) 2002-10-31 US claimed
US-20020161007-A1 Non-steroidal modulators of estrogen receptors PROVOST, FELLOWS AND SCHOLARS OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) 2002-10-31 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-20020161007-A1 Non-steroidal modulators of estrogen receptors ESRRB, ESR2, ESRRG ESR1 6/4885EBP 70/4885SIGMAR1 348/4885

“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.