SCHEMBL4875315

SCHEMBL4875315

O=C(Nc1nsc(-c2ccc(F)c(C(F)(F)F)c2)n1)c1ccc(I)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.53
HTT P42858 2/20 0.53
RAB9A P51151 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 1/20 0.53
MPL P40238 12/20 0.47
KDM4E B2RXH2 2/20 0.46
TP53 P04637 2/20 0.46
HSD17B10 Q99714 1/20 0.46
TRPV1 Q8NER1 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
KCNE1 P15382 1/20 0.40
KCNQ1 P51787 1/20 0.40
KMO O15229 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 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
SCHEMBL4868637 0.82 MPL (0.67) NPC1HTTRAB9ASMN1; SMN2GAA
SCHEMBL4877682 0.82 MPL (0.66) MPLADORA3
SCHEMBL4868170 0.75 MPL (0.67) MPLKCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL4868589 0.74 MPL (0.68) RAB9AMPLTRPV1KCNQ3KCNQ2
SCHEMBL4876795 0.68 ADORA3 (0.67) NPC1RAB9ASMN1; SMN2MAPTMPL
SCHEMBL4872535 0.68 MPL (0.72) MPL
SCHEMBL4872557 0.67 MPL (0.80) MPL
SCHEMBL29641409 0.65 HDAC6 (0.58) NPC1RAB9AGAAMAPTMPL
SCHEMBL1034612 0.63 KDR (0.48) NPC1RAB9AMAPTMPLKMO
SCHEMBL1035371 0.62 RAB9A (0.46) RAB9AGAAMPLTP53HSD17B10

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
US-20080076771-A1 Thrombopoietin Receptor Agonists REITER LAWRENCE A 2008-03-27 US disclosed
EP-1794156-A2 TROMBOPOIETIN RECEPTOR AGONISTS Pfizer Products Incorporated (US) 2007-06-13 EP disclosed
WO-2006033005-A2 THROMBOPOIETIN RECEPTOR AGONISTS PFIZER PRODUCTS INC. (US) 2006-03-30 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-20080076771-A1 Thrombopoietin Receptor Agonists MPL, THPO, TBXA2R NPC1 4382/4885HTT 4788/4885RAB9A 2219/4885

“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.