SCHEMBL9524636

SCHEMBL9524636

Cc1ccc2nnc(C(=O)Nc3ccc(F)cc3)c(O)c2c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.49
RAB9A P51151 5/20 0.49
NPC1 O15118 4/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
LMNA P02545 2/20 0.49
ALOX15 P16050 1/20 0.49
POLB P06746 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
CTNNB1 P35222 6/20 0.45
TCF7L2 Q9NQB0 6/20 0.45
RXFP1 Q9HBX9 1/20 0.45
GAA P10253 1/20 0.43
SNCA P37840 1/20 0.43
HPGD P15428 2/20 0.42
TP53 P04637 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL9524278 0.90 SNCA (0.47) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL9525587 0.87 ADORA3 (0.47) MAPTRAB9ANPC1SMN1; SMN2POLB
SCHEMBL9524788 0.87 KCNK3 (0.49) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL9525125 0.85 MAPT (0.50) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL9524408 0.85 P2RX1 (0.53) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL9525537 0.84 KCNK3 (0.49) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL9525813 0.84 MEN1 (0.50) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL9524293 0.82 TP53 (0.46) RAB9ANPC1SMN1; SMN2POLBHPGD
SCHEMBL9525863 0.82 RAB9A (0.49) MAPTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL9525673 0.80 MAOB (0.50) RAB9ANPC1SMN1; SMN2LMNAPOLB

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 3 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 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