SCHEMBL10516280

SCHEMBL10516280

CN1CC2CCC1CN(c1cc3c(cc1F)c(=O)ccn3C1CC1)C2

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 2/20 0.40
▸ TOP2B Q02880 2/20 0.40
▸ KDM4E B2RXH2 4/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ LMNA P02545 3/20 0.38
▸ HPGD P15428 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ PIK3CG P48736 5/20 0.35
▸ PIK3CD O00329 3/20 0.35
▸ PIK3R1 P27986 3/20 0.35
▸ PIK3CA P42336 3/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL14585956 0.81 ALDH1A1 (0.48) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL10947254 0.79 KDM4E (0.44) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL10480278 0.78 KDM4E (0.66) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL20286630 0.77 KCNH2 (0.48) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL30615686 0.77 ALDH1A1 (0.61) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL1915366 0.77 ALDH1A1 (0.61) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL10475103 0.76 TOP2A (0.49) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL29742967 0.76 TOP2A (0.49) TOP2ATOP2BKDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL29744471 0.75 TOP2A (0.48) TOP2ATOP2BKDM4EALDH1A1LMNA
SCHEMBL10945859 0.74 KDM4E (0.48) TOP2ATOP2BKDM4EALDH1A1LMNA

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
EP-0297858-A2 Bridged-diazabicycloalkyl quinolone carboxylic acids and esters PFIZER INC. (US) 1989-01-04 — — EP claimed
Send feedback