SCHEMBL9786232

SCHEMBL9786232

Cn1cc(C(=O)O)c(=O)c2cc3cc(F)c(N4CCN(O)CC4)c(F)c3nc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.48
ADRA2B P18089 1/20 0.42
MAPK1 P28482 1/20 0.42
HPGD P15428 6/20 0.41
HSD17B10 Q99714 6/20 0.41
ALDH1A1 P00352 6/20 0.41
ALB P02768 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
LMNA P02545 3/20 0.40
CYP2C9 P11712 1/20 0.40
ATP6V1B2 P21281 1/20 0.40
TBXA2R P21731 1/20 0.40
EDNRA P25101 1/20 0.40
TARBP2 Q15633 1/20 0.40
TUBB4A P04350 1/20 0.40
POLB P06746 1/20 0.40
TUBB P07437 1/20 0.40
TUBA3C P0DPH7 1/20 0.40
TUBA1B P68363 1/20 0.40
TUBA4A P68366 1/20 0.40

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
SCHEMBL9527325 0.93 KDM4E (0.57) KDM4EADRA2BMAPK1HPGDHSD17B10
SCHEMBL9775884 0.89 LMNA (0.52) KDM4EADRA2BMAPK1HPGDHSD17B10
SCHEMBL9786183 0.87 KMT2A (0.42) KDM4EHPGDHSD17B10ALDH1A1MEN1
SCHEMBL9776172 0.86 LMNA (0.49) KDM4EADRA2BMAPK1HPGDHSD17B10
SCHEMBL8942010 0.84 KDM4E (0.41) KDM4EADRA2BMAPK1HPGDHSD17B10
SCHEMBL8941910 0.83 KDM4E (0.40) KDM4EADRA2BMAPK1HPGDHSD17B10
SCHEMBL9775962 0.83 KDM4E (0.60) KDM4EHPGDHSD17B10ALDH1A1ALB
SCHEMBL8941989 0.83 LMNA (0.40) KDM4EHPGDHSD17B10ALDH1A1LMNA
SCHEMBL8942075 0.82 KDM4E (0.39) KDM4EADRA2BMAPK1HPGDHSD17B10
SCHEMBL8941990 0.82 LMNA (0.45) KDM4EHPGDHSD17B10ALDH1A1LMNA

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-5053509-A Microbiocides; AIDS LABORATOIRE ROGER BELLON (FR) 1991-10-01 US disclosed