SCHEMBL14254741

SCHEMBL14254741

O=C1C2CCCN2C(=O)N1Cc1cc(Cl)cc(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 7/20 0.47
▸ LMNA P02545 1/20 0.47
▸ ALDH1A1 P00352 8/20 0.45
▸ KDM4E B2RXH2 6/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ ADORA2A P29274 1/20 0.43
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ RAD52 P43351 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ HTR1A P08908 2/20 0.39
▸ AR P10275 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ CASP1 P29466 1/20 0.39

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
SCHEMBL5739701 0.78 ADORA2A (0.60) ALDH1A1HPGDKMT2AMEN1ADORA2A
SCHEMBL4846236 0.76 AR (0.58) SMN1; SMN2LMNAALDH1A1KDM4EHPGD
SCHEMBL4846248 0.76 AR (0.58) SMN1; SMN2LMNAALDH1A1KDM4EHPGD
SCHEMBL13879492 0.72 AR (0.53) SMN1; SMN2ALDH1A1KMT2AMEN1POLB
SCHEMBL11056954 0.69 KMT2A (0.58) SMN1; SMN2ALDH1A1KDM4EHPGDALOX12
SCHEMBL5738724 0.69 KDM4E (0.60) SMN1; SMN2ALDH1A1KDM4EHPGDALOX12
SCHEMBL9380400 0.68 SMN1; SMN2 (0.52) SMN1; SMN2LMNAALDH1A1KDM4EKMT2A
SCHEMBL4248531 0.67 SMN1; SMN2 (0.63) SMN1; SMN2LMNAALDH1A1KDM4EKMT2A
SCHEMBL5739138 0.67 SMN1; SMN2 (0.63) SMN1; SMN2LMNAALDH1A1KDM4EKMT2A
SCHEMBL11502497 0.66 AR (0.47) SMN1; SMN2ALDH1A1KMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7342012-B2 Inhibitors of αLβ2 mediated cell adhesion MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-03-11 — — US disclosed
US-7342012-B2 Inhibitors of αLβ2 mediated cell adhesion MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-03-11 — — US disclosed
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