SCHEMBL13604229

SCHEMBL13604229

NNC(=O)c1ccccc1CCc1ccnc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 1/20 0.49
▸ NSD2 O96028 1/20 0.46
▸ FLT1 P17948 2/20 0.46
▸ KDR P35968 2/20 0.46
▸ CYP1A2 P05177 1/20 0.45
▸ P2RX7 Q99572 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ADORA2A P29274 1/20 0.41
▸ ADORA1 P30542 1/20 0.41
▸ ADRB2 P07550 1/20 0.41
▸ PABPC1 P11940 1/20 0.41
▸ EIF4H Q15056 1/20 0.41
▸ HDAC3 O15379 1/20 0.41
▸ HDAC4 P56524 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC7 Q8WUI4 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41

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
SCHEMBL13604226 0.82 ALDH1A1 (0.55) LOXL2NSD2FLT1KDRCYP1A2
SCHEMBL5603305 0.82 NSD2 (0.56) LOXL2NSD2P2RX7ALDH1A1HDAC3
SCHEMBL1346778 0.80 MEN1 (0.50) LOXL2NSD2CYP1A2ALDH1A1MEN1
SCHEMBL16572948 0.77 NSD2 (0.67) NSD2P2RX7ALDH1A1MEN1KMT2A
Biphenyl SCHEMBL27669532 0.77 NSD2 (0.55) LOXL2NSD2CYP1A2ALDH1A1HDAC3
SCHEMBL13604312 0.75 KDR (0.64) KDRCYP1A2P2RX7ALDH1A1ADRB2
SCHEMBL22994602 0.73 ALDH1A1 (0.71) KDRALDH1A1KMT2AADRB2HDAC1
SCHEMBL3412935 0.72 GAA (0.62) P2RX7ALDH1A1MEN1KMT2AADRB2
SCHEMBL1650885 0.72 CYP1A2 (0.55) LOXL2FLT1KDRCYP1A2ALDH1A1
SCHEMBL30286812 0.72 CTSD (0.51) KDRCYP1A2P2RX7ALDH1A1MEN1

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-2128156-A1 NOVEL OXADIAZOLE DERIVATIVES AND THIADIAZOLE DERIVATIVES HAVING NEOVASCULARIZATION INHIBITING ACTIVITY Santen Pharmaceutical Co., Ltd (JP) 2009-12-02 — — EP disclosed
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