SCHEMBL1574048

SCHEMBL1574048

O=C(Oc1n[nH]c2cc(F)ccc12)N1CCC(F)(F)CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 4/20 0.41
NTRK1 P04629 1/20 0.41
MAP2K4 P45985 5/20 0.40
MAPK1 P28482 4/20 0.40
MAPK6 Q16659 1/20 0.40
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39
CNR1 P21554 1/20 0.39
RBP4 P02753 1/20 0.38
HTR2A P28223 1/20 0.37
PLK1 P53350 1/20 0.36
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL1573971 0.91 MAP2K4 (0.42) NTRK1MAP2K4MAPK1MAPK6ABL1
SCHEMBL1573862 0.87 ALDH1A1 (0.44) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573781 0.85 MAP2K4 (0.41) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1574198 0.85 TP53 (0.47) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573919 0.85 HRH4 (0.47) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573920 0.85 MAP2K4 (0.41) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573854 0.85 RBP4 (0.45) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573594 0.85 ALDH1A1 (0.41) NTRK1MAP2K4MAPK1ALDH1A1CYP3A4
SCHEMBL1573835 0.83 GAA (0.45) MAP2K4MAPK1MAPK6ABL1BCR
SCHEMBL1573746 0.82 RBP4 (0.48) GRM4MAP2K4MAPK1MAPK6ABL1

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