SCHEMBL9674236

SCHEMBL9674236

CN(CCO)c1c(Cl)cnn(CC=Cc2ccccc2)c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
MAPK1 P28482 2/20 0.35
TSHR P16473 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HPGD P15428 1/20 0.34
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
POLB P06746 2/20 0.34
MCHR1 Q99705 1/20 0.34
ALDH1A1 P00352 4/20 0.33
NPBWR1 P48145 2/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC2 Q92769 1/20 0.33
ALDH2 P05091 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL7005110 0.81 TSHR (0.36) NPC1RAB9AMAPK1TSHRSMN1; SMN2
SCHEMBL7005108 0.81 TSHR (0.36) NPC1RAB9AMAPK1TSHRSMN1; SMN2
SCHEMBL9125199 0.77 RAB9A (0.54) NPC1RAB9AMAPK1TSHRSMN1; SMN2
SCHEMBL9125192 0.77 RAB9A (0.54) NPC1RAB9AMAPK1TSHRSMN1; SMN2
Fumaric Acid SCHEMBL9737068 0.72 HSP90AA1 (0.39) NPC1RAB9ATSHRSMN1; SMN2MEN1
Fumaric Acid SCHEMBL9737079 0.72 HSP90AA1 (0.39) NPC1RAB9ATSHRSMN1; SMN2MEN1
SCHEMBL27417397 0.72 HPGD (0.43) MAPK1TSHRSMN1; SMN2HPGDMEN1
SCHEMBL9672584 0.72 NPC1 (0.37) NPC1RAB9ATSHRSMN1; SMN2HPGD
SCHEMBL9672954 0.70 MEN1 (0.38) NPC1RAB9AMAPK1MEN1KMT2A
SCHEMBL7003258 0.70 NPC1 (0.45) NPC1RAB9AMAPK1TSHRSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0517877-A1 NOVEL 3(2H)-PYRIDAZINONES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1992-12-16 EP disclosed
WO-1992012137-A1 NOVEL 3(2H)-PYRIDAZINONES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME Richter Gedeon Vegyészeti Gyár Rt. (HU) 1992-07-23 WO disclosed