SCHEMBL9524895

SCHEMBL9524895

CCN(C(=O)c1nnc2ccccc2c1O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
TSHR P16473 3/20 0.47
GLA P06280 1/20 0.47
HTT P42858 1/20 0.46
TP53 P04637 2/20 0.46
HPGD P15428 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
LCK P06239 1/20 0.39
MAP2K3 P46734 1/20 0.39
MAP2K6 P52564 1/20 0.39
BTK Q06187 1/20 0.39
MAP3K19 Q56UN5 1/20 0.39
NEK10 Q6ZWH5 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL9524674 0.82 KMT2A (0.45) HTTHPGDMEN1KMT2ALCK
SCHEMBL9527775 0.75 CYP1A2 (0.47) TSHRHPGDLCKMAP2K3MAP2K6
SCHEMBL31371878 0.74 LCK (0.51) ALDH1A1TSHRHPGDMEN1KMT2A
SCHEMBL7706331 0.74 LCK (0.51) ALDH1A1TSHRHPGDMEN1KMT2A
SCHEMBL9525627 0.74 LCK (0.40) HTTMEN1KMT2ALCKMAP2K3
SCHEMBL9525025 0.74 ALDH1A1 (0.44) ALDH1A1
SCHEMBL9524656 0.73 CYP1A2 (0.43) TSHRHPGD
SCHEMBL9523543 0.72 MEN1 (0.44) TSHRHPGDMEN1KMT2ANPC1
SCHEMBL10861354 0.71 KDM4E (0.51) ALDH1A1TSHRGLATP53HPGD
SCHEMBL9525642 0.70 KDM4E (0.51) ALDH1A1TSHRHTTTP53HPGD

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