SCHEMBL11399693

SCHEMBL11399693

Cn1ccn(-c2ccc(Cc3ccccc3)cc2)c1=O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HCAR1 Q9BXC0 1/20 0.43
▸ CALM1 P0DP23 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.39
▸ PDE3B Q13370 1/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ FAAH O00519 1/20 0.38
▸ MGLL Q99685 1/20 0.38
▸ LTA4H P09960 1/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ TDP2 O95551 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.37
▸ IDH1 O75874 1/20 0.36
▸ NR3C1 P04150 1/20 0.36
▸ ATM Q13315 1/20 0.36

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
SCHEMBL7133435 0.84 GSK3A (0.48) LMNAKDM4EMGLLALDH1A1HPGD
SCHEMBL11401372 0.79 PDE3B (0.40) RXFP1PDE3BPDE3AKDM4EALDH1A1
SCHEMBL11388402 0.77 MGLL (0.49) LMNAFAAHMGLLLTA4HIDH1
SCHEMBL11402098 0.76 PAK1 (0.36) LMNAPDE3BPDE3AHRH3HPGD
SCHEMBL17664675 0.74 RGS4 (0.47) HCAR1LMNAKDM4EMGLLALDH1A1
SCHEMBL12362740 0.73 TDP1 (0.41) LMNAKDM4EMGLLALDH1A1KDM4C
SCHEMBL22349820 0.73 GSK3A (0.44) KDM4EFAAHMGLLHPGDATM
SCHEMBL1728658 0.72 LTA4H (0.70) LTA4HHRH3
SCHEMBL14280098 0.70 ALDH1A1 (0.47) HCAR1LMNAKDM4EMGLLALDH1A1
SCHEMBL30931108 0.69 ALOX5 (0.42) KDM4EALDH1A1HPGD

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-4279637-A Herbicidal N-substituted 4-imidazolin-2-ones VELSICOL CHEMICAL CORPORATION (US) 1981-07-21 — — US disclosed
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