SCHEMBL7366344

SCHEMBL7366344

O=c1nnc(-c2cccc(Br)c2)c2[nH]cccc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.50
IDO1 P14902 3/20 0.43
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
CSNK1D P48730 1/20 0.37
METAP2 P50579 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
KMT2A Q03164 3/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
DCUN1D1 Q96GG9 1/20 0.35
TDP2 O95551 1/20 0.35
CAMK2D Q13557 1/20 0.34
MEN1 O00255 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CDC7 O00311 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL7370627 0.84 MAOB (0.51) MAOBIDO1KMT2AALDH1A1CYP1A2
SCHEMBL7370353 0.80 MAOB (0.53) MAOBSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL7362866 0.79 MEN1 (0.44) IDO1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL7365581 0.77 CDK8 (0.48) NPC1RAB9AALDH1A1HPGD
SCHEMBL7369411 0.75 RAB9A (0.42) NPC1RAB9ASMN1; SMN2KMT2ATP53
SCHEMBL7364174 0.74 KDR (0.46) NPC1RAB9ASMN1; SMN2KMT2ADCUN1D1
SCHEMBL28647816 0.72 MAOB (0.45) MAOBIDO1NPC1RAB9ACSNK1D
SCHEMBL7368926 0.72 CDK4 (0.47) MAOBIDO1NPC1RAB9ASMN1; SMN2
SCHEMBL7360220 0.72 MAP2K4 (0.40) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL7367836 0.71 IKBKB (0.42) ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0612321-A1 PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1994-08-31 EP disclosed
WO-1993007146-A1 BENZO AND PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1993-04-15 WO disclosed