SCHEMBL11909375

SCHEMBL11909375

CN1CCC(NC(=O)c2ccc(-c3c(F)cnc4[nH]c5cnc(-c6cccnc6)cc5c34)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 16/20 0.53
WNT1 P04628 13/20 0.53
PIM1 P11309 1/20 0.42
CHEK1 O14757 1/20 0.41
ACHE P22303 1/20 0.41
ATR Q13535 1/20 0.41
AURKA O14965 1/20 0.40
AURKB Q96GD4 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
SCHEMBL11908845 0.93 RIPK1 (0.46) DYRK1AWNT1PIM1CHEK1ACHE
SCHEMBL11908594 0.92 DYRK1A (0.43) DYRK1AWNT1PIM1CHEK1ACHE
SCHEMBL473784 0.89 DYRK1A (0.44) DYRK1AWNT1PIM1CHEK1ACHE
SCHEMBL11908797 0.89 GSK3B (0.44) DYRK1AWNT1CHEK1ACHE
SCHEMBL473803 0.88 USP30 (0.45) DYRK1AWNT1PIM1CHEK1ACHE
SCHEMBL473768 0.87 CHEK1 (0.42) DYRK1AWNT1PIM1CHEK1ACHE
SCHEMBL473597 0.86 DYRK1A (0.51) DYRK1AWNT1PIM1CHEK1ACHE
SCHEMBL11909390 0.86 DYRK1A (0.46) DYRK1AWNT1PIM1CHEK1ACHE
SCHEMBL473748 0.86 CHEK1 (0.44) CHEK1ACHE
SCHEMBL11929463 0.85 RIPK1 (0.49) PIM1CHEK1ACHEATR

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 4 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
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 DYRK1A 3775/4885WNT1 3606/4885PIM1 3366/4885

“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.