SCHEMBL8932214

SCHEMBL8932214

Cc1nc(-c2ccc(Oc3ccccc3)cc2)c[nH]1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
XDH P47989 1/20 0.46
LTA4H P09960 4/20 0.45
SCN4A P35499 2/20 0.42
MCL1 Q07820 4/20 0.42
NISCH Q9Y2I1 1/20 0.41
TSHR P16473 1/20 0.40
PSD A5PKW4 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
GSTP1 P09211 1/20 0.40
RIPK1 Q13546 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
SCHEMBL3669956 0.84 MEN1 (0.43) NPC1RAB9ATSHR
SCHEMBL1008901 0.84 MEN1 (0.46) NPC1RAB9ATSHR
Hydrochloric Acid SCHEMBL1307189 0.82 MEN1 (0.44) NPC1RAB9ATSHR
Bromide SCHEMBL28138957 0.82 KMT2A (0.44) NPC1RAB9ATSHR
SCHEMBL7141260 0.81 NPC1 (0.50) NPC1RAB9AXDHLTA4HSCN4A
SCHEMBL12735602 0.81 PDGFRB (0.50) NPC1RAB9A
SCHEMBL17983446 0.80 ENPP3 (0.36) NPC1RAB9A
SCHEMBL3747961 0.77 CYP1A2 (0.49) NPC1RAB9ATSHRCYP11B1CYP11B2
SCHEMBL19626728 0.77 NPC1 (0.49) NPC1RAB9AXDH
SCHEMBL8250696 0.76 METAP2 (0.44) NPC1RAB9ANISCH

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
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

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 NPC1 581/4885RAB9A 967/4885XDH 282/4885

“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.