SCHEMBL30207018

SCHEMBL30207018

O=C(O)c1cccc(OCc2ccccc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 8/20 1.00
SRD5A2 P31213 1/20 0.80
MAOB P27338 1/20 0.77
MRGPRX4 Q96LA9 4/20 0.75
MEN1 O00255 1/20 0.75
KMT2A Q03164 1/20 0.75
NR1H4 Q96RI1 1/20 0.74
SMPD1 P17405 1/20 0.72
NR4A1 P22736 1/20 0.71
NR4A3 Q92570 1/20 0.71
FFAR1 O14842 1/20 0.70
PTPN1 P18031 1/20 0.68
TSHR P16473 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68

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
SCHEMBL339009 1.00 NR4A2 (1.00) NR4A2SRD5A2MAOBMRGPRX4MEN1
Hydrochloric Acid SCHEMBL4748074 0.98 NR4A2 (0.97) NR4A2SRD5A2MAOBMRGPRX4MEN1
SCHEMBL1122713 0.97 NR4A2 (0.94) NR4A2SRD5A2MAOBMRGPRX4MEN1
SCHEMBL1123155 0.95 NR4A2 (0.91) NR4A2SRD5A2MAOBMRGPRX4MEN1
SCHEMBL4406160 0.93 NR4A2 (0.87) NR4A2SRD5A2MRGPRX4SMN1; SMN2
SCHEMBL30994900 0.90 NR4A2 (0.82) NR4A2SRD5A2MAOBMRGPRX4MEN1
SCHEMBL27815839 0.90 NR4A2 (0.82) NR4A2SRD5A2MAOBMRGPRX4MEN1
SCHEMBL4138759 0.90 NR4A2 (0.81) NR4A2MRGPRX4SMN1; SMN2
SCHEMBL7908051 0.90 SRD5A2 (0.85) NR4A2SRD5A2MAOBMRGPRX4MEN1
SCHEMBL3442746 0.88 NR4A2 (0.79) NR4A2SRD5A2MAOBMRGPRX4MEN1

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
CN-117255792-A Heteroaryl derivatives, process for preparing the same and pharmaceutical compositions comprising the same as active ingredient 沃若诺伊公司 2023-12-19 CN disclosed
EP-3002280-B1 CYCLIC TRIAZO AND DIAZO SODIUM CHANNEL BLOCKERS UNIV GREENWICH (GB) 2023-05-24 EP disclosed
CN-115835869-A Process for the synthesis of nifedibenzodiazepinone 阿默制药有限公司 2023-03-21 CN disclosed