SCHEMBL4868622

SCHEMBL4868622

O=C(Nc1cnccn1)c1ccc(F)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.74
NPC1 O15118 3/20 0.68
RAB9A P51151 3/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
TP53 P04637 1/20 0.68
MAPT P10636 1/20 0.68
NFKB1 P19838 1/20 0.68
NFKB2 Q00653 1/20 0.68
RELA Q04206 1/20 0.68
CHRNB2 P17787 1/20 0.60
CHRNB4 P30926 1/20 0.60
CHRNA3 P32297 1/20 0.60
CHRNA4 P43681 1/20 0.60
CYP11B1 P15538 1/20 0.59
CYP11B2 P19099 1/20 0.59
LMNA P02545 1/20 0.58
KDM4E B2RXH2 3/20 0.57
TSHR P16473 3/20 0.57
ALOX15 P16050 1/20 0.57
CASP1 P29466 1/20 0.57

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
SCHEMBL29016187 0.84 KMT2A (0.74) KMT2ANPC1RAB9ASMN1; SMN2TP53
SCHEMBL29409256 0.84 KMT2A (0.74) KMT2ANPC1RAB9ASMN1; SMN2TP53
SCHEMBL18398726 0.84 KMT2A (0.74) KMT2ANPC1RAB9ASMN1; SMN2TP53
SCHEMBL45148 0.83 KMT2A (0.73) KMT2ANPC1RAB9ASMN1; SMN2TP53
SCHEMBL30533391 0.82 KMT2A (0.71) KMT2ANPC1RAB9ASMN1; SMN2TP53
SCHEMBL29238994 0.82 KMT2A (0.71) KMT2ANPC1RAB9ASMN1; SMN2TP53
SCHEMBL22410921 0.81 NPC1 (0.70) KMT2ANPC1RAB9ASMN1; SMN2TP53
SCHEMBL30182416 0.81 KMT2A (0.70) KMT2ANPC1RAB9ASMN1; SMN2TP53
SCHEMBL4516495 0.80 KMT2A (0.73) KMT2ANPC1RAB9ASMN1; SMN2TP53
Trifluoroacetic Acid SCHEMBL3676575 0.79 TSHR (0.66) KMT2ANPC1RAB9ASMN1; SMN2TP53

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 KMT2A 1800/4885NPC1 4382/4885RAB9A 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.