SCHEMBL8917082

SCHEMBL8917082

c1ccc2c(c1)Oc1cccc3ccn-2c13

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 11/20 0.38
NPSR1 Q6W5P4 2/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPK1 P28482 1/20 0.36
ATM Q13315 1/20 0.36
AHR P35869 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL15883052 0.76 AHR (0.34) P2RX4AHR
SCHEMBL16523549 0.75
SCHEMBL17809829 0.69 ALDH1A1 (0.38) SMN1; SMN2KDM4EMAPK1ATM
SCHEMBL4501683 0.68 P2RX4 (0.36) P2RX4NPSR1SMN1; SMN2MAPK1
SCHEMBL2039172 0.68 FGFR1 (0.42) P2RX4MAPK1
SCHEMBL14454865 0.67 P2RX4 (0.36) P2RX4NPSR1MAPTSMN1; SMN2AHR
SCHEMBL18770825 0.65 POLB (0.52) P2RX4NPSR1MAPTSMN1; SMN2KDM4E
SCHEMBL30867065 0.65 POLB (0.52) P2RX4NPSR1MAPTSMN1; SMN2KDM4E
SCHEMBL14244249 0.65 P2RX4 (0.47) P2RX4NPSR1MAPTSMN1; SMN2
SCHEMBL31414163 0.65 P2RX4 (0.47) P2RX4NPSR1MAPTSMN1; SMN2

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
US-5624929-A Pyrroloquinoline and pyrrolophenothiazine carboxamides and related compounds PFIZER INC. (US) 1997-04-29 US disclosed
US-5403839-A Antiinflammatory agents; arthritis; respiratory system disorders PFIZER INC (US) 1995-04-04 US disclosed
WO-1989008654-A1 PYRROLOQUINOLINE AND PYRROLOPHENOTHIAZINE CARBOXAMIDES AND RELATED COMPOUNDS PFIZER INC. (US) 1989-09-21 WO disclosed
EP-0332364-A2 Pyrroloquinoline and pyrrolophenothiazine carboxamides and related compounds PFIZER INC. (US) 1989-09-13 EP disclosed