SCHEMBL14916697

SCHEMBL14916697

CC(C)C[C@H]1c2[nH]c3ccc(Cl)cc3c2CCN1C(=O)CCN1CCC(F)CC1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.54
KIF11 P52732 11/20 0.51
LMNA P02545 1/20 0.49
STAT3 P40763 1/20 0.49
ABCB1 P08183 1/20 0.49
ABCG2 Q9UNQ0 1/20 0.49
SIRT1 Q96EB6 2/20 0.48
MAPT P10636 2/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL14916698 1.00 KDM4E (0.54) KDM4EKIF11LMNASTAT3ABCB1
SCHEMBL14917266 0.95 KDM4E (0.52) KDM4EKIF11LMNASTAT3ABCB1
SCHEMBL14917265 0.95 KDM4E (0.52) KDM4EKIF11LMNASTAT3ABCB1
SCHEMBL14925343 0.93 KDM4E (0.54) KDM4EKIF11LMNASTAT3ABCB1
SCHEMBL14917157 0.93 KDM4E (0.51) KDM4EKIF11LMNASTAT3ABCB1
SCHEMBL14925345 0.93 KDM4E (0.51) KDM4EKIF11LMNASTAT3ABCB1
SCHEMBL14917159 0.93 KDM4E (0.51) KDM4EKIF11LMNASTAT3ABCB1
SCHEMBL14916504 0.92 KDM4E (0.51) KDM4EKIF11LMNASTAT3ABCB1
SCHEMBL14916505 0.92 KDM4E (0.51) KDM4EKIF11LMNASTAT3ABCB1
SCHEMBL14925331 0.91 LMNA (0.59) KDM4EKIF11LMNASTAT3ABCB1

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
WO-2013067409-A1 ANTIMICROBIAL CARBOLINE COMPOUNDS ALCON RESEARCH, LTD. (US) 2013-05-10 WO disclosed
US-20130116219-A1 ANTIMICROBIAL CARBOLINE COMPOUNDS ALCON RESEARCH, LTD. (US) 2013-05-09 US disclosed
US-20130116219-A1 ANTIMICROBIAL CARBOLINE COMPOUNDS ALCON RESEARCH, LTD. (US) 2013-05-09 US disclosed
US-20130116219-A1 ANTIMICROBIAL CARBOLINE COMPOUNDS ALCON RESEARCH, LTD. (US) 2013-05-09 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-20130116219-A1 ANTIMICROBIAL CARBOLINE COMPOUNDS MAVS, OPA1, ZC3HAV1 KDM4E 2855/4885KIF11 2480/4885LMNA 4318/4885

“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.