SCHEMBL10923937

SCHEMBL10923937

COC(=O)c1cccc(COc2cccc(CCCCCCOC3CCCCO3)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP4F2 P78329 2/20 0.47
CYP4A11 Q02928 2/20 0.47
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
GPR84 Q9NQS5 1/20 0.43
PRKDC P78527 1/20 0.42
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
PPM1D O15297 1/20 0.40
SMPD1 P17405 1/20 0.40

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
SCHEMBL4490282 0.82 PPM1D (0.49) MRGPRX4CYP4F2CYP4A11LMNAHPGD
SCHEMBL2499084 0.82 KMT2A (0.53) MRGPRX4MEN1KMT2ALMNAHPGD
SCHEMBL11095166 0.81 MRGPRX4 (0.63) MRGPRX4CYP4F2CYP4A11LMNASMPD1
SCHEMBL19889483 0.81 LMNA (0.44) MRGPRX4MEN1KMT2ACYP4F2CYP4A11
SCHEMBL18105999 0.81 LMNA (0.44) MRGPRX4MEN1KMT2ACYP4F2CYP4A11
SCHEMBL10680301 0.81 KDM4C (0.50) MEN1KMT2ACYP4F2CYP4A11
SCHEMBL10677816 0.80 MEN1 (0.49) MEN1KMT2ACNR1CNR2
SCHEMBL10684106 0.80 MEN1 (0.49) MEN1KMT2ACNR1CNR2
SCHEMBL10682241 0.79 MEN1 (0.48) MEN1KMT2ACNR1CNR2
SCHEMBL11098354 0.79 MRGPRX4 (0.60) MRGPRX4CYP4F2CYP4A11SMPD1

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-0181568-A2 Anti-inflammatory/anti-allergic compounds RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1986-05-21 EP claimed
EP-0110405-A2 Antiinflammatory/antiallergic compounds RORER INTERNATIONAL (OVERSEAS) INC. (a Delaware corporation) (US) 1984-06-13 EP disclosed