SCHEMBL9657309

SCHEMBL9657309

Cc1ccc2c(C(=O)O)c(F)ccc2n1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 10/20 0.45
PDE10A Q9Y233 2/20 0.44
ALDH1A1 P00352 4/20 0.41
TSHR P16473 1/20 0.41
POLB P06746 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
DHFR P00374 1/20 0.39
ALKBH5 Q6P6C2 1/20 0.39
FABP3 P05413 1/20 0.38
FABP4 P15090 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL25487575 0.82 ALDH1A1 (0.51) DHODHPDE10AALDH1A1TSHRPOLB
SCHEMBL3837660 0.79 P2RX7 (0.48) DHODHPDE10AALDH1A1TSHRKMT2A
SCHEMBL5215349 0.77 ALDH1A1 (0.41) ALDH1A1POLBMEN1KMT2AKDM4E
SCHEMBL23858724 0.76 ALDH1A1 (0.45) DHODHALDH1A1TSHRPOLBMEN1
SCHEMBL30251746 0.76 ALDH1A1 (0.45) DHODHALDH1A1TSHRPOLBMEN1
SCHEMBL4058945 0.76 ALDH1A1 (0.43) ALDH1A1POLBKMT2AKDM4ERAB9A
SCHEMBL9248212 0.76 ALDH1A1 (0.43) DHODHALDH1A1POLBKDM4ERAB9A
SCHEMBL10785665 0.74 P2RX7 (0.44) ALDH1A1POLBMEN1KMT2AKDM4E
SCHEMBL31556360 0.73 ALDH1A1 (0.41) ALDH1A1POLBKDM4ERAB9A
SCHEMBL564237 0.73 KDM4E (0.44) ALDH1A1TSHRPOLBKMT2AKDM4E

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0109284-B1 6,7-DIHYDRO-5,8-DIMETHYL-9-FLUORO-1-OXO-1H,5H-BENZO(IJ)QUINOLIZINE-2-CARBOXYLIC ACID AND DERIVATIVES RIKER LABORATORIES, INC. (US) 1989-01-11 EP claimed
US-4585868-A BACTERICIDES RIKER LABORATORIES, INC. (US) 1986-04-29 US claimed
EP-0109284-A1 6,7-Dihydro-5,8-dimethyl-9-fluoro-1-oxo-1H,5H-benzo(ij)quinolizine-2-carboxylic acid and derivatives RIKER LABORATORIES, INC. (US) 1984-05-23 EP claimed
EP-0245913-B1 Process for preparing 6,7-dihydro-5,8-dimethyl-9-fluoro-1-oxo-1H,5H-benzo[i,j]quinolizine-2-carboxylic acid RIKER LABORATORIES, INC. (US) 1992-03-25 EP disclosed
US-4898945-A Process for 6,7-dihydro-5,8-dimethyl-9-fluoro-1-oxo-1H,5H-benzo[i,j]quinolizine-2-carboxylic acid MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-02-06 US disclosed
EP-0109284-B1 6,7-DIHYDRO-5,8-DIMETHYL-9-FLUORO-1-OXO-1H,5H-BENZO(IJ)QUINOLIZINE-2-CARBOXYLIC ACID AND DERIVATIVES RIKER LABORATORIES, INC. (US) 1989-01-11 EP disclosed
EP-0245913-A1 Process for preparing 6,7-dihydro-5,8-dimethyl-9-fluoro-1-oxo-1H,5H-benzo[i,j]quinolizine-2-carboxylic acid RIKER LABORATORIES, INC. (US) 1987-11-19 EP disclosed
EP-0079162-B1 DERIVATIVES OF 8-AMINO AND 8-AMINOMETHYL BENZO(IJ)QUINOLIZINE RIKER LABORATORIES, INCORPORATED (US) 1986-07-23 EP disclosed
US-4585868-A BACTERICIDES RIKER LABORATORIES, INC. (US) 1986-04-29 US disclosed
US-4585868-A BACTERICIDES RIKER LABORATORIES, INC. (US) 1986-04-29 US disclosed
US-4565872-A 5-CYANOQUINALDINE AND 6-FLUORO DERIVATIVE, MICROBIOCIDES RIKER LABORATORIES, INC. (US) 1986-01-21 US disclosed
US-4472405-A Antimicrobial 6,7-dihydro-5,8-dimethyl-9 fluoro-1-oxo-1H, 5H-benzo (ij) quinolizine-2-carboxylic acid and derivatives RIKER LABORATORIES, INC. (US) 1984-09-18 US disclosed
EP-0109284-A1 6,7-Dihydro-5,8-dimethyl-9-fluoro-1-oxo-1H,5H-benzo(ij)quinolizine-2-carboxylic acid and derivatives RIKER LABORATORIES, INC. (US) 1984-05-23 EP disclosed
US-4404207-A Antimicrobial 8-substituted benzo [IJ]quinolizines RIKER LABORATORIES, INC. (US) 1983-09-13 US disclosed
US-4400386-A UROGENITAL DISORDERS; PLANT DISEASES RIKER LABORATORIES, INC. (US) 1983-08-23 US disclosed
EP-0079162-A1 Derivatives of 8-amino and 8-aminomethyl benzo(ij)quinolizine RIKER LABORATORIES, INCORPORATED (US) 1983-05-18 EP disclosed
US-4380543-A BACTERICIDES RIKER LABORATORIES, INC. (US) 1983-04-19 US disclosed