SCHEMBL18551002

SCHEMBL18551002

CC(C)CCOc1cccc(CCCN)c1-c1cc(CCCN)cc(OCCCC(N)=O)c1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CSF3R Q99062 2/20 0.51
LTB4R Q15722 15/20 0.41
LTB4R2 Q9NPC1 3/20 0.41
HTT P42858 1/20 0.39
CYP2C9 P11712 2/20 0.39

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
SCHEMBL19262623 0.71 CSF3R (0.34) CSF3R
SCHEMBL2208586 0.70 PPARG (0.47) CSF3R
SCHEMBL29818702 0.70 PPARG (0.47) CSF3R
SCHEMBL2207505 0.70 CSF3R (0.48) CSF3R
SCHEMBL20682472 0.67 PTGES (0.36)
SCHEMBL20332193 0.66 MCHR1 (0.37) CSF3RHTTCYP2C9
SCHEMBL26922790 0.65 TAAR1 (0.56) HTT
SCHEMBL20682471 0.64 BRD4 (0.32) LTB4RLTB4R2
SCHEMBL3964539 0.64 TAAR1 (0.45) CSF3R
SCHEMBL4569074 0.64 PPARA (0.48)

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-10639286-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2020-05-05 US disclosed
US-20190183816-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2019-06-20 US disclosed
US-9737496-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2017-08-22 US disclosed
US-20170049722-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2017-02-23 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 (3 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-20190183816-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER CSF3R 4033/4885LTB4R 177/4885LTB4R2 157/4885
US-20170049722-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER CSF3R 4033/4885LTB4R 177/4885LTB4R2 157/4885
US-10639286-B2 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER CSF3R 4033/4885LTB4R 177/4885LTB4R2 157/4885

“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.