SCHEMBL10685180

SCHEMBL10685180

O=C1NC(=O)/C(=C/c2ccc3c(c2)CCCN3Cc2ccccc2)S1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 9/20 0.61
▸ KMT2A Q03164 4/20 0.61
▸ ALDH1A1 P00352 3/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.61
▸ MEN1 O00255 3/20 0.61
▸ POLB P06746 2/20 0.61
▸ LMNA P02545 1/20 0.61
▸ CRHBP P24387 1/20 0.61
▸ CRHR2 Q13324 1/20 0.61
▸ L3MBTL1 Q9Y468 1/20 0.61
▸ KDM4E B2RXH2 2/20 0.60
▸ MAPT P10636 2/20 0.60
▸ RECQL P46063 2/20 0.60
▸ HTT P42858 1/20 0.58
▸ HKDC1 Q2TB90 1/20 0.58
▸ MAOA P21397 4/20 0.50
▸ MAOB P27338 4/20 0.50
▸ PIM1 P11309 2/20 0.50
▸ PIM2 Q9P1W9 2/20 0.50
▸ PIM3 Q86V86 1/20 0.50

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
SCHEMBL10685183 1.00 HPGD (0.61) HPGDKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL10690338 0.84 PIM1 (0.50) HPGDKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL10690333 0.84 PIM1 (0.50) HPGDKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL10685116 0.82 HPGD (0.47) HPGDKMT2AMEN1POLBMAOA
SCHEMBL10691674 0.80 HPGD (0.47) HPGDKMT2AMEN1POLBMAOA
SCHEMBL10691680 0.80 HPGD (0.47) HPGDKMT2AMEN1POLBMAOA
SCHEMBL1461837 0.79 ALDH1A1 (0.56) HPGDKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL24991950 0.78 HPGD (0.59) HPGDKMT2AALDH1A1MEN1MAPT
SCHEMBL10687171 0.78 HPGD (0.59) HPGDKMT2AALDH1A1MEN1MAPT
SCHEMBL10687991 0.78 HPGD (0.47) HPGDKMT2AMEN1POLBMAOA

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
US-4738972-A Hypoglycemic thiazolidinediones PFIZER INC. (US) 1988-04-19 — — US disclosed
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