SCHEMBL6199814

SCHEMBL6199814

O=C(NCc1ccc(Cl)cc1)c1cnc2c(CCCO)cc(C(F)(F)F)cc2c1O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX1 P51575 1/20 0.45
TMPRSS4 Q9NRS4 1/20 0.45
LMNA P02545 2/20 0.45
CNR2 P34972 2/20 0.43
EGLN1 Q9GZT9 1/20 0.42
CCR1 P32246 3/20 0.41
TACR1 P25103 1/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 1/20 0.39
KDM1A O60341 1/20 0.39
HDAC1 Q13547 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL6201118 0.88 EGLN1 (0.44) LMNAEGLN1HPGD
SCHEMBL6204166 0.85 EGLN1 (0.43) LMNAEGLN1HPGD
SCHEMBL6199810 0.84 LMNA (0.46) P2RX1TMPRSS4LMNACNR2EGLN1
SCHEMBL6201589 0.84 EGLN1 (0.42) LMNAEGLN1HPGD
SCHEMBL6203808 0.84 EGLN1 (0.49) LMNACNR2EGLN1HPGD
SCHEMBL6201955 0.84 EGLN1 (0.42) EGLN1HPGD
SCHEMBL6201571 0.84 SMN1; SMN2 (0.45) LMNACNR2EGLN1MAPT
SCHEMBL6200398 0.81 EGLN1 (0.44) LMNAEGLN1HPGD
SCHEMBL6201600 0.79 EGLN1 (0.47) LMNACNR2EGLN1HPGD
SCHEMBL6201231 0.79 EGLN1 (0.44) LMNACNR2EGLN1HPGD

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-1042295-B1 4-HYDROXYQUINOLINE-3-CARBOXAMIDES AND HYDRAZIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN CO LLC (US) 2005-09-07 EP claimed