SCHEMBL7809458

SCHEMBL7809458

Oc1ccccc1Oc1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.47
NR1I2 O75469 1/20 0.47
LMNA P02545 1/20 0.47
PGR P06401 1/20 0.47
HSP90AA1 P07900 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
MAPT P10636 1/20 0.47
HSPA5 P11021 1/20 0.47
HPGD P15428 1/20 0.47
CBR1 P16152 1/20 0.47
TBXA2R P21731 1/20 0.47
SLC6A2 P23975 1/20 0.47
AGTR1 P30556 1/20 0.47
SLC6A3 Q01959 1/20 0.47
FFAR1 O14842 2/20 0.47
KMT2A Q03164 2/20 0.46
STK39 Q9UEW8 2/20 0.45
SCN8A Q9UQD0 1/20 0.44
SCN10A Q9Y5Y9 1/20 0.44
MRGPRX4 Q96LA9 5/20 0.44

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
SCHEMBL11095171 0.89 KMT2A (0.51) TTRHPGDFFAR1KMT2ASCN8A
SCHEMBL28395070 0.87 KMT2A (0.58) TTRLMNAMAPTHPGDFFAR1
SCHEMBL9644001 0.85 STK39 (0.47) HPGDFFAR1STK39MRGPRX4
SCHEMBL10707742 0.85 FFAR1 (0.54) TTRFFAR1KMT2AMRGPRX4MEN1
SCHEMBL11447947 0.83 FFAR1 (0.48) TTRNR1I2LMNAPGRHSP90AA1
SCHEMBL7803868 0.82 AR (0.46) TTRNR1I2LMNAPGRHSP90AA1
SCHEMBL7803948 0.82 TTR (0.49) TTRNR1I2LMNAPGRHSP90AA1
SCHEMBL10729862 0.82 MRGPRX4 (0.51) TTRNR1I2LMNAPGRHSP90AA1
SCHEMBL9373632 0.81 CYP1A2 (0.62) TTRLMNAMAPTFFAR1KMT2A
SCHEMBL28400372 0.81 KMT2A (0.46) TTRLMNAMAPTHPGDFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109890807-B Heterocyclic substituted bicyclic azoles as pesticides FMC 公司 2023-04-04 CN disclosed
EP-0863132-B1 KETONITRILE DERIVATIVES AND ANTIBACTERIAL AGENT AND DRUG CONTAINING THE SAME TOKUYAMA CORP (JP) 2001-06-13 EP disclosed
US-5968977-A ANTIBIOTIC RESISTANT INFECTIONS TOKUYAMA CORPORATION (JP) 1999-10-19 US disclosed
EP-0863132-A1 KETONITRILE DERIVATIVES AND ANTIBACTERIAL AGENT AND DRUG CONTAINING THE SAME TOKUYAMA CORPORATION (JP) 1998-09-09 EP disclosed