SCHEMBL1573971

SCHEMBL1573971

CC1(C)CCN(C(=O)Oc2n[nH]c3cc(F)ccc23)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 6/20 0.42
MAPK1 P28482 2/20 0.40
MAPK6 Q16659 1/20 0.40
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39
HTR2A P28223 1/20 0.39
RBP4 P02753 1/20 0.38
NTRK1 P04629 1/20 0.37
ALDH1A1 P00352 2/20 0.36
ACACB O00763 1/20 0.36
ACACA Q13085 1/20 0.36
GSK3B P49841 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
USP2 O75604 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NAMPT P43490 1/20 0.35

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
SCHEMBL1574048 0.91 GRM4 (0.41) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573919 0.87 HRH4 (0.47) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573862 0.87 ALDH1A1 (0.44) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573835 0.85 GAA (0.45) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573920 0.85 MAP2K4 (0.41) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573854 0.85 RBP4 (0.45) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1574198 0.85 TP53 (0.47) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573781 0.85 MAP2K4 (0.41) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573594 0.85 ALDH1A1 (0.41) MAP2K4MAPK1NTRK1ALDH1A1CYP1A2
SCHEMBL1573680 0.82 RBP4 (0.43) MAP2K4MAPK1MAPK6ABL1BCR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1713779-B1 INDAZOLE DERIVATIVES AS INHIBITORS OF HORMONE-SENSITIVE LIPASES SANOFI AVENTIS DEUTSCHLAND (DE) 2011-04-13 EP disclosed