SCHEMBL9523679

SCHEMBL9523679

O=C(Nc1cccc(Br)c1)c1nnc2ccccc2c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX1 P51575 1/20 0.52
EGFR P00533 1/20 0.51
FLT1 P17948 3/20 0.48
KDR P35968 3/20 0.48
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
LMNA P02545 1/20 0.48
ALOX15 P16050 1/20 0.48
PDGFRB P09619 2/20 0.46
KIT P10721 2/20 0.46
FLT4 P35916 2/20 0.46
MAOB P27338 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HTT P42858 1/20 0.46
GAA P10253 1/20 0.46
GRM5 P41594 1/20 0.45
TP53 P04637 1/20 0.44
TSHR P16473 1/20 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
SCHEMBL9524877 0.85 ADORA3 (0.56) KMT2AMEN1RAB9ALMNAHTT
SCHEMBL9527500 0.85 ABCG2 (0.51) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL9527182 0.85 NPC1 (0.52) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL9524794 0.85 ADORA3 (0.48) ALDH1A1ADORA3
SCHEMBL9524321 0.85 FLT3 (0.57) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL9524250 0.85 HIF1A (0.58) P2RX1KDRKMT2AMEN1NPC1
SCHEMBL9524357 0.81 KMT2A (0.56) P2RX1FLT1KDRKMT2AMEN1
SCHEMBL9523496 0.81 FLT3 (0.60) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL9524822 0.81 HIF1A (0.60) P2RX1KMT2AMEN1NPC1RAB9A
SCHEMBL9525725 0.79 KMT2A (0.49) P2RX1EGFRFLT1KDRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0277791-B1 CINNOLINE-CARBOXAMIDES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1993-06-02 EP claimed
EP-0277791-A2 Cinnoline-carboxamides and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1988-08-10 EP claimed
EP-0277791-B1 CINNOLINE-CARBOXAMIDES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1993-06-02 EP disclosed
US-4826837-A IMMUNOMODULATORS FARMITALIA CARLO ERBA S.R.L. (IT) 1989-05-02 US disclosed
EP-0277791-A2 Cinnoline-carboxamides and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1988-08-10 EP disclosed