SCHEMBL4686964

SCHEMBL4686964

c1ccc(OCc2nc(-c3ccc(Oc4ccccc4)cc3)c[nH]2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.46
XDH P47989 2/20 0.45
RAB9A P51151 7/20 0.44
NPC1 O15118 6/20 0.44
LTA4H P09960 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KCNH2 Q12809 1/20 0.40
ENPP3 O14638 1/20 0.40
ENPP1 P22413 1/20 0.40
MAPT P10636 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 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
SCHEMBL4456543 0.95 MCL1 (0.54) MCL1XDHRAB9ANPC1SMN1; SMN2
SCHEMBL4460360 0.95 LTA4H (0.47) MCL1XDHRAB9ANPC1LTA4H
SCHEMBL3270671 0.93 MAOA (0.46) MCL1XDHRAB9ANPC1LTA4H
SCHEMBL4680696 0.93 MCL1 (0.48) MCL1XDHRAB9ANPC1LTA4H
SCHEMBL4460188 0.93 NPC1 (0.45) MCL1XDHRAB9ANPC1LTA4H
SCHEMBL4456749 0.93 PRMT5 (0.43) MCL1XDHRAB9ANPC1LTA4H
SCHEMBL4455245 0.93 NPC1 (0.50) MCL1XDHRAB9ANPC1LTA4H
Hydrochloric Acid SCHEMBL4461345 0.92 XDH (0.45) MCL1XDHRAB9ANPC1LTA4H
SCHEMBL4680834 0.91 MAOB (0.47) MCL1XDHRAB9ANPC1LTA4H
SCHEMBL4455715 0.91 MAOB (0.47) MCL1SMN1; SMN2MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1638943-B1 NOVEL IMIDAZOLE DERIVATIVES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS A MEDICAMENT SOD CONSEILS RECH APPLIC (FR) 2008-08-06 EP claimed
JP-2007501267-A 2007-01-25 JP claimed
EP-1638943-A2 NOVEL IMIDAZOLE DERIVATIVES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS A MEDICAMENT Société de Conseils de Recherches et d'Applications Scientifiques ( S.C.R.A.S.) (FR) 2006-03-29 EP claimed
WO-2004106307-A2 NOVEL IMIDAZOLE DERIVATIVES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS A MEDICAMENT SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2004-12-09 WO claimed
US-8188133-B2 Imidazole derivatives, preparation and user thereof as medicine IPSEN PHARMA S.A.S. (FR) 2012-05-29 US disclosed
US-8188133-B2 Imidazole derivatives, preparation and user thereof as medicine IPSEN PHARMA S.A.S. (FR) 2012-05-29 US disclosed
US-20090186930-A1 NOVEL IMIDAZOLE DERIVATIVES, PREPARATION AND USER THEREOF AS MEDICINE SOCIETE DE CONSEILS DE RECHERCHES ET D' APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2009-07-23 US disclosed
US-20090186930-A1 NOVEL IMIDAZOLE DERIVATIVES, PREPARATION AND USER THEREOF AS MEDICINE SOCIETE DE CONSEILS DE RECHERCHES ET D' APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2009-07-23 US disclosed
EP-1638943-B1 NOVEL IMIDAZOLE DERIVATIVES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS A MEDICAMENT SOD CONSEILS RECH APPLIC (FR) 2008-08-06 EP disclosed
EP-1638943-A2 NOVEL IMIDAZOLE DERIVATIVES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS A MEDICAMENT Société de Conseils de Recherches et d'Applications Scientifiques ( S.C.R.A.S.) (FR) 2006-03-29 EP disclosed
WO-2004106307-A2 NOVEL IMIDAZOLE DERIVATIVES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS A MEDICAMENT SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2004-12-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090186930-A1 NOVEL IMIDAZOLE DERIVATIVES, PREPARATION AND USER THEREOF AS MEDICINE CYP51A1, IKZF3, MIF MCL1 86/4885XDH 282/4885RAB9A 967/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.