SCHEMBL473670

SCHEMBL473670

Cn1cc(-c2cc3c(cn2)[nH]c2ncc(F)c(I)c23)cn1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 9/20 0.52
CHEK1 O14757 1/20 0.51
ACHE P22303 1/20 0.51
MAPT P10636 6/20 0.50
PIM3 Q86V86 1/20 0.45
PIM2 Q9P1W9 1/20 0.45
MAP4K1 Q92918 4/20 0.44
NTRK1 P04629 2/20 0.44
KIT P10721 2/20 0.44
FLT3 P36888 2/20 0.44

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
SCHEMBL473684 0.83 CHEK1 (0.58) PIM1CHEK1ACHEMAPTPIM3
SCHEMBL12666733 0.80 CHEK1 (0.69) PIM1CHEK1ACHEMAPTPIM3
SCHEMBL474985 0.79 CHEK1 (0.46) PIM1CHEK1ACHEMAPTPIM3
SCHEMBL11908677 0.78 CHEK1 (0.47) PIM1CHEK1ACHEMAPTPIM3
SCHEMBL1560490 0.78 MAPT (0.53) PIM1CHEK1ACHEMAPTPIM3
SCHEMBL473714 0.78 MKNK1 (0.46) PIM1CHEK1ACHEMAPTPIM3
SCHEMBL11907789 0.78 CHEK1 (0.47) PIM1CHEK1ACHEMAPTPIM3
SCHEMBL1560881 0.77 CHEK1 (0.44) PIM1CHEK1ACHEMAPTPIM3
SCHEMBL1561284 0.77 MAPT (0.81) PIM1CHEK1ACHEMAPTPIM3
SCHEMBL1560658 0.76 CHEK1 (0.54) PIM1CHEK1ACHEMAPTPIM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120208809-A1 9H-PYRROLO[2,3-B: 5,4-C'] DIPYRIDINE AZACARBOLINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-08-16 US disclosed
US-20120208809-A1 9H-PYRROLO[2,3-B: 5,4-C'] DIPYRIDINE AZACARBOLINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-08-16 US disclosed
US-20120208809-A1 9H-PYRROLO[2,3-B: 5,4-C'] DIPYRIDINE AZACARBOLINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-08-16 US disclosed
EP-2411389-A2 9H-PYRROLO[2,3-B: 5,4-C']DIPYRIDINE AZACARBOLINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-02-01 EP disclosed
WO-2010109084-A2 9H-PYRROLO[2,3-B: 5,4-C'] DIPYRIDINE AZACARBOLINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-09-30 WO disclosed
WO-2010109084-A2 9H-PYRROLO[2,3-B: 5,4-C'] DIPYRIDINE AZACARBOLINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-09-30 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-20120208809-A1 9H-PYRROLO[2,3-B: 5,4-C'] DIPYRIDINE AZACARBOLINE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF NPR3, CCNH, CBR3 PIM1 3366/4885CHEK1 1152/4885ACHE 4455/4885

“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.