SCHEMBL9079794

SCHEMBL9079794

CC1CC(=O)c2c(N3CCNC4(CCC4)C3)c(F)cc3c(=O)c(C(=O)O)cn1c23

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
KDM4E B2RXH2 10/20 0.46
ALDH1A1 P00352 6/20 0.46
HPGD P15428 6/20 0.46
HSD17B10 Q99714 6/20 0.46
ALB P02768 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
AADAT Q8N5Z0 2/20 0.46
POLB P06746 2/20 0.46
TUBB4A P04350 1/20 0.46
TUBB P07437 1/20 0.46
TUBA3C P0DPH7 1/20 0.46
TUBA1B P68363 1/20 0.46
TUBA4A P68366 1/20 0.46
TUBB4B P68371 1/20 0.46
TUBB3 Q13509 1/20 0.46
TUBB2A Q13885 1/20 0.46
TUBB8 Q3ZCM7 1/20 0.46
TUBA3E Q6PEY2 1/20 0.46
TUBA1A Q71U36 1/20 0.46

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
SCHEMBL9079798 1.00 LMNA (0.47) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9079284 0.97 LMNA (0.48) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9079291 0.97 LMNA (0.48) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9703760 0.89 LMNA (0.49) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9080247 0.85 TOP2A (0.53) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9080242 0.85 TOP2A (0.53) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9703124 0.85 LMNA (0.55) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9080358 0.84 KDM4E (0.67) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9080362 0.84 KDM4E (0.67) LMNAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9079551 0.83 ALDH1A1 (0.56) LMNAKDM4EALDH1A1HPGDHSD17B10

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-5508428-A Spiro compound DAIICHI PHAMACEUTICAL CO., LTD. (JP) 1996-04-16 US disclosed
EP-0357047-B1 Spiro compounds DAIICHI SEIYAKU CO (JP) 1993-11-03 EP disclosed