SCHEMBL5144488

SCHEMBL5144488

C1CN2CC12.O=C(c1ccc(F)cc1)N1CCCC1

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 11/20 0.74
▸ ALDH1A1 P00352 2/20 0.74
▸ KDM4E B2RXH2 1/20 0.74
▸ MEN1 O00255 1/20 0.74
▸ KMT2A Q03164 1/20 0.74
▸ L3MBTL3 Q96JM7 12/20 0.64
▸ MBTD1 Q05BQ5 4/20 0.62
▸ TP53BP1 Q12888 1/20 0.62
▸ L3MBTL4 Q8NA19 1/20 0.62
▸ HSD11B1 P28845 1/20 0.57
▸ HPGD P15428 1/20 0.56
▸ NPC1 O15118 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ ATM Q13315 1/20 0.55

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
SCHEMBL13024627 0.87 L3MBTL1 (0.81) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL1735171 0.87 L3MBTL1 (0.81) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL31334408 0.85 HPGD (0.76) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL3355334 0.84 HPGD (0.80) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL18867940 0.84 HPGD (0.80) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL517817 0.82 HPGD (0.77) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL643480 0.82 ALDH1A1 (0.69) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL5337680 0.80 ALDH1A1 (0.67) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL1735976 0.80 L3MBTL1 (0.70) L3MBTL1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL1735966 0.80 L3MBTL1 (0.70) L3MBTL1ALDH1A1KDM4EMEN1KMT2A

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
WO-2007136668-A9 N-BENZOYL-AND N-BENZYLPYRROLIDIN-3-YLAMINES AS HISTAMINE-3 ANTAGONISTS WYETH CORP (US) 2008-03-27 — — WO disclosed
Send feedback