SCHEMBL4898371

SCHEMBL4898371

CCC(C)Oc1ccc2c(c1)-c1cc(OC(C)CC)ccc1C2

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.41
HTR2C P28335 5/20 0.40
HTR2A P28223 4/20 0.40
APP P05067 1/20 0.37
BACE1 P56817 1/20 0.37
ACACB O00763 3/20 0.36
GPBAR1 Q8TDU6 1/20 0.36
CYSLTR1 Q9Y271 1/20 0.36
METAP1 P53582 1/20 0.36
MAPT P10636 1/20 0.35
CES2 O00748 1/20 0.34
MCHR1 Q99705 1/20 0.34
BRD4 O60885 1/20 0.33

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
SCHEMBL4896222 0.89 HTR2A (0.40) FFAR4HTR2CHTR2AAPPBACE1
SCHEMBL15395532 0.85 CYP1A2 (0.46) HTR2CMAPTMCHR1
SCHEMBL4897533 0.81 CES2 (0.45) HTR2CHTR2AMETAP1MAPTCES2
SCHEMBL122883 0.76 ACACB (0.45) ACACBGPBAR1CYSLTR1MAPTMCHR1
SCHEMBL340041 0.74 HDAC1 (0.42) FFAR4ACACBGPBAR1CYSLTR1MAPT
SCHEMBL4899699 0.73 NQO1 (0.52) BACE1METAP1MAPTCES2BRD4
SCHEMBL11665507 0.72 GPBAR1 (0.55) GPBAR1CYSLTR1MAPTMCHR1
SCHEMBL19122983 0.72 SMN1; SMN2 (0.59) ACACBGPBAR1CYSLTR1MAPT
SCHEMBL10749835 0.72 HDAC1 (0.43) FFAR4ACACBGPBAR1CYSLTR1MAPT
SCHEMBL2091722 0.71 ACACB (0.40) FFAR4ACACBGPBAR1CYSLTR1MAPT

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-8084559-B2 Ethylene-vinylcyclohexane copolymers SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-12-27 US disclosed
US-20080161514-A1 Transition Metal Complex, Process For Producing Said Transition Metal Complex, Substituent-Carrying Fluorene Compound, Process For Producing Said Fluorene Compound, Catalyst Component For Olefin Polymerization, Catalyst For Olefin Polymerization, and Process For Producing Olefin Polymer SUMITOMO CHEMICAL COMPANY, LIMTIED (JP) 2008-07-03 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-20080161514-A1 Transition Metal Complex, Process For Producing Said Transition Metal Complex, Substituent-Carrying Fluorene Compound, Process For Producing Said Fluorene Compound, Catalyst Component For Olefin Polymerization, Catalyst For Olefin Polymerization, and Process For Producing Olefin Polymer AOC2, ACSL1, ACSL3 FFAR4 2648/4885HTR2C 4009/4885HTR2A 4366/4885

“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.