SCHEMBL13815221

SCHEMBL13815221

Cc1ccc(C(C)(c2ccc(C)cc2)c2ccc(O)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 11/20 0.67
ESR1 P03372 10/20 0.67
ACHE P22303 1/20 0.65
TSHR P16473 2/20 0.56
CYP3A4 P08684 2/20 0.56
HPGD P15428 2/20 0.56
HSD17B10 Q99714 2/20 0.56
LMNA P02545 1/20 0.56
TYR P14679 1/20 0.56
AR P10275 1/20 0.56
SLC6A2 P23975 1/20 0.56
SLC6A4 P31645 1/20 0.56
HTR6 P50406 1/20 0.56
ESRRG P62508 1/20 0.56
SLC6A3 Q01959 1/20 0.56
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
ALDH1A1 P00352 2/20 0.48
SHBG P04278 1/20 0.46
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL3143096 1.00 ESR2 (0.67) ESR2ESR1ACHETSHRCYP3A4
SCHEMBL12299307 0.93 ESR1 (0.70) ESR2ESR1ACHETSHRCYP3A4
SCHEMBL22782579 0.93 ESR1 (0.70) ESR2ESR1ACHETSHRCYP3A4
SCHEMBL19901313 0.93 ESR1 (0.70) ESR2ESR1ACHETSHRCYP3A4
SCHEMBL10774292 0.93 ESR1 (0.59) ESR2ESR1ACHETSHRCYP3A4
SCHEMBL2385710 0.93 ESR1 (0.70) ESR2ESR1ACHETSHRCYP3A4
SCHEMBL822977 0.91 ESR1 (0.83) ESR2ESR1ACHETSHRCYP3A4
SCHEMBL22335854 0.89 ESR1 (0.80) ESR2ESR1ACHETSHRCYP3A4
SCHEMBL21694220 0.89 ESR1 (0.55) ESR2ESR1ACHETSHRCYP3A4
SCHEMBL18750 0.89 ESR1 (0.80) ESR2ESR1ACHETSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090153021-A1 LARGE-BANDGAP HOST MATERIALS FOR PHOSPHORESCENT EMITTERS WASHINGTON, UNIVERSITY OF (US) 2009-06-18 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-20090153021-A1 LARGE-BANDGAP HOST MATERIALS FOR PHOSPHORESCENT EMITTERS IQGAP1, SGTA, DPAGT1 ESR2 826/4885ESR1 967/4885ACHE 2679/4885

“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.