SCHEMBL9853609

SCHEMBL9853609

Clc1ccc(Oc2cccnc2)c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
LMNA P02545 4/20 0.47
TDP1 Q9NUW8 4/20 0.47
ESRRA P11474 1/20 0.46
CYP19A1 P11511 4/20 0.45
MAPT P10636 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
HSP90AA1 P07900 1/20 0.43
CCR6 P51684 1/20 0.43
HTT P42858 2/20 0.42
CYP2A6 P11509 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
MEN1 O00255 1/20 0.41
HPGD P15428 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
SCHEMBL11477740 0.80 TDP1 (0.53) ALDH1A1SMN1; SMN2LMNATDP1CYP19A1
SCHEMBL9853596 0.75 GAA (0.49) ALDH1A1LMNATDP1ESRRAMAPT
SCHEMBL10544257 0.73 LMNA (0.50) ALDH1A1SMN1; SMN2LMNATDP1CYP19A1
SCHEMBL4796250 0.73 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2LMNATDP1CYP19A1
SCHEMBL5593294 0.73 SMN1; SMN2 (0.53) ALDH1A1SMN1; SMN2LMNATDP1CYP19A1
SCHEMBL30222343 0.73 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2LMNATDP1CYP19A1
SCHEMBL4034382 0.73 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2LMNATDP1CYP19A1
SCHEMBL676142 0.72 LMNA (0.82) ALDH1A1SMN1; SMN2LMNATDP1CYP19A1
SCHEMBL30535283 0.72 LMNA (0.82) ALDH1A1SMN1; SMN2LMNATDP1CYP19A1
SCHEMBL10964527 0.71 ESRRA (0.56) ALDH1A1SMN1; SMN2LMNATDP1ESRRA

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-0405426-A2 Naphthylamino- and naphthyloxy-pyridinamines and related compounds, a process for their preparation and their use as dermatological agents HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-01-02 EP claimed