SCHEMBL4812865

SCHEMBL4812865

[CH2]CCc1ccc(O)cn1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.46
ESR2 Q92731 7/20 0.46
HRH3 Q9Y5N1 1/20 0.32
ME2 P23368 3/20 0.31
ME1 P48163 3/20 0.31
ME3 Q16798 3/20 0.31
FFAR1 O14842 1/20 0.31
DEGS1 O15121 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL4813003 0.82
SCHEMBL2429377 0.80 ESR1 (0.47) ESR1ESR2FFAR1DEGS1MEN1
SCHEMBL8193278 0.78 ESR1 (0.50) ESR1ESR2DEGS1NPC1RAB9A
SCHEMBL4252852 0.78 ESR1 (0.46) ESR1ESR2FFAR1DEGS1MEN1
SCHEMBL807517 0.77
SCHEMBL20133367 0.77 ESR1 (0.44) ESR1ESR2FFAR1DEGS1
SCHEMBL17141720 0.76 ESR2 (0.41) ESR1ESR2CYP2D6
SCHEMBL6810902 0.75 ESR1 (0.47) ESR1ESR2DEGS1CYP1A2MEN1
SCHEMBL20436993 0.75 ESR1 (0.43) ESR1ESR2DEGS1NPC1RAB9A
SCHEMBL1924446 0.75

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-7320986-B2 Fused tri and tetra-cyclic pyrazole kinase inhibitors ABBOTT LABORTORIES (US) 2008-01-22 US disclosed
EP-1603885-A1 FUSED TRI AND TETRA-CYCLIC PYRAZOLE KINASE INHIBITORS Abbott Laboratories (US) 2005-12-14 EP disclosed
US-20040259904-A1 Fused tri and tetra-cyclic pyrazole kinase inhibitors ABBVIE INC. 2004-12-23 US disclosed
WO-2004080973-A1 FUSED TRI AND TETRA-CYCLIC PYRAZOLE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2004-09-23 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-20040259904-A1 Fused tri and tetra-cyclic pyrazole kinase inhibitors TK1, MAP3K19, MAP3K20 ESR1 3443/4885ESR2 2286/4885HRH3 2806/4885

“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.