SCHEMBL7249097

SCHEMBL7249097

Oc1ccc(C2C[CH]CCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 18/20 0.52
ESR1 P03372 6/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2D6 P10635 1/20 0.47
DEGS1 O15121 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
SCHEMBL29097441 0.80 ALDH1A1 (0.41)
SCHEMBL780217 0.79 SLC18A3 (0.43) CYP2D6
SCHEMBL5704310 0.79 ESR2 (0.61) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL56284 0.78 ESR2 (0.69) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL2094843 0.78 ESR2 (0.76) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL11871181 0.76 ESR2 (0.80) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL699003 0.76 ESR2 (0.67) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL698472 0.76 ESR2 (0.67) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL698289 0.76 ESR2 (0.67) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL28569320 0.76 ESR2 (0.67) ESR2ESR1CYP3A4CYP2C9CYP2D6

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-20030158428-A1 Intermediates and processes for preparing substituted chromanol derivatives PFIZER INC. 2003-08-21 US disclosed
WO-2002060888-A1 PROCESSES FOR PREPARING CHROMANYLBENZOIC ACIDS PFIZER PRODUCTS INC. (US) 2002-08-08 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-20030158428-A1 Intermediates and processes for preparing substituted chromanol derivatives CYP1A1, CYP2F1, CYP7A1 ESR2 497/4885ESR1 392/4885CYP3A4 27/4885

“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.