SCHEMBL841600

SCHEMBL841600

Nc1ncnn2c(CN3CCNC(=O)C3)cc(-c3ccc(NC(=O)Nc4cc(C(F)(F)F)ccc4F)cc3F)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.48
FLT3 P36888 5/20 0.45
KDR P35968 5/20 0.45
CSF1R P07333 4/20 0.45
FLT1 P17948 4/20 0.45
KIT P10721 4/20 0.45
FGFR1 P11362 3/20 0.45
FRK P42685 3/20 0.45
MAPK9 P45984 3/20 0.45
RPS6KA3 P51812 3/20 0.45
MAP4K2 Q12851 3/20 0.45
AXL P30530 3/20 0.45
GSK3A P49840 3/20 0.45
GSK3B P49841 3/20 0.45
LCK P06239 3/20 0.45
LYN P07948 3/20 0.45
FLT4 P35916 3/20 0.45
BLK P51451 3/20 0.45
PRKCD Q05655 2/20 0.45
PLK4 O00444 2/20 0.45

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
SCHEMBL58416 0.93 KDR (0.51) FLT3KDRCSF1RFLT1KIT
SCHEMBL60045 0.92 FLT3 (0.47) ERN1FLT3KDRCSF1RFLT1
SCHEMBL58420 0.88 FLT3 (0.54) FLT3KDRCSF1RFLT1KIT
SCHEMBL59668 0.87 FLT3 (0.58) ERN1FLT3KDRCSF1RFLT1
SCHEMBL59369 0.87 FLT3 (0.49) ERN1FLT3KDRCSF1RFLT1
SCHEMBL58142 0.85 ACVRL1 (0.57) ERN1FLT3KDRCSF1RFLT1
SCHEMBL59275 0.84 FLT3 (0.51) ERN1FLT3KDRCSF1RFLT1
SCHEMBL58929 0.83 FLT3 (0.48) ERN1FLT3KDRCSF1RFLT1
SCHEMBL59832 0.82 ACVRL1 (0.50) ERN1FLT3KDRCSF1RFLT1
SCHEMBL58187 0.81 ACVRL1 (0.46) ERN1FLT3KDRCSF1RFLT1

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-8143393-B2 Substituted 4-amino-pyrrolotriazine derivatives useful for treating hyper-proliferative disorders and diseases associated with angiogenesis BAYER HEALTHCARE LLC (US) 2012-03-27 US disclosed
US-20100063038-A1 Substituted 4-Amino-Pyrrolotriazine Derivatives Useful for Treating Hyper-Proliferative Disorders and Diseases Associated with Angiogenesis BAYER HEALTHCARE LLC 2010-03-11 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-20100063038-A1 Substituted 4-Amino-Pyrrolotriazine Derivatives Useful for Treating Hyper-Proliferative Disorders and Diseases Associated with Angiogenesis CDK4, CDKL4, MKI67 ERN1 4551/4885FLT3 299/4885KDR 41/4885

“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.