SCHEMBL8942372

SCHEMBL8942372

COn1cc(C(=O)O)c(=O)c2nc3cc(F)c(F)cc3cc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 3/20 0.33
TOP2B Q02880 3/20 0.33
LMNA P02545 2/20 0.33
CYP2C9 P11712 1/20 0.33
ATP6V1B2 P21281 1/20 0.33
TBXA2R P21731 1/20 0.33
EDNRA P25101 1/20 0.33
TARBP2 Q15633 1/20 0.33
ALDH1A1 P00352 6/20 0.32
KDM4E B2RXH2 3/20 0.32
HPGD P15428 3/20 0.32
HSD17B10 Q99714 3/20 0.32
TSHR P16473 2/20 0.32
HTT P42858 2/20 0.32
BRD4 O60885 1/20 0.32
CYP2J2 P51589 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CHRM1 P11229 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL8942417 0.83 LMNA (0.39) TOP2ATOP2BLMNACYP2C9ATP6V1B2
SCHEMBL8136324 0.75 ALDH1A1 (0.44) TOP2ATOP2BLMNACYP2C9ALDH1A1
SCHEMBL9259220 0.72 MAP2K1 (0.37) ALDH1A1KDM4EHPGD
SCHEMBL9775901 0.71 TOP2A (0.38) TOP2ATOP2BLMNACYP2C9ATP6V1B2
SCHEMBL9536515 0.71 LMNA (0.32) TOP2ATOP2BLMNACYP2C9ATP6V1B2
SCHEMBL9775973 0.71 ALDH1A1 (0.52) TOP2ATOP2BLMNACYP2C9ATP6V1B2
SCHEMBL9775920 0.69 ALDH1A1 (0.52) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL8942074 0.69 KMT2A (0.46) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6605949 0.68 LMNA (0.41) TOP2ATOP2BLMNACYP2C9ATP6V1B2
SCHEMBL6213315 0.68 ALDH1A1 (0.41) TOP2ATOP2BLMNACYP2C9ALDH1A1

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-5556861-A 1,8 benzonaphthyridine derivatives and antimicrobial compositions LABORATOIRE ROGER BELLON (FR) 1996-09-17 US disclosed
US-4990515-A Chemical intermediates RHONE-POULENC SANTE (FR) 1991-02-05 US disclosed