SCHEMBL14694279

SCHEMBL14694279

Cn1nc(-c2ccc(Cl)cc2Br)cc1Br

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 3/20 0.38
▸ CRHR1 P34998 2/20 0.34
▸ NPBWR1 P48145 1/20 0.34
▸ NR2F2 P24468 1/20 0.34
▸ KMT2A Q03164 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ USP2 O75604 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HTR2A P28223 1/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KCNH2 Q12809 1/20 0.31
▸ AMY1A P0DUB6 1/20 0.31
▸ MAPK8 P45983 1/20 0.31
▸ MAPK9 P45984 1/20 0.31
▸ MMP12 P39900 1/20 0.31

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
SCHEMBL31696760 0.77 MAPT (0.47) KMT2AALDH1A1HPGDMEN1
SCHEMBL20599056 0.71 S100A4 (0.46) NPBWR1ALDH1A1
SCHEMBL14996550 0.68 HSD11B1 (0.54) HSD11B1CRHR1KMT2AALDH1A1USP2
SCHEMBL15331519 0.67 SMN1; SMN2 (0.40) HSD11B1CRHR1NPBWR1NR2F2KMT2A
SCHEMBL15330034 0.67 CYP1A2 (0.40) HSD11B1CRHR1NPBWR1NR2F2KMT2A
SCHEMBL4032763 0.67 HSD11B1 (0.49) HSD11B1CRHR1KMT2AALDH1A1USP2
SCHEMBL22658975 0.67 HSD11B1 (0.41) HSD11B1CRHR1KMT2AMEN1
SCHEMBL7707702 0.67 KMO (0.42) HSD11B1CRHR1
SCHEMBL16347107 0.66 KMT2A (0.48) HSD11B1KMT2A
SCHEMBL12297649 0.66 HSD11B1 (0.40) HSD11B1CRHR1KMT2AALDH1A1

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-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 — — EP disclosed
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