SCHEMBL17967624

SCHEMBL17967624

Cn1cc(-c2cc3[nH]c4ncccc4c3cn2)cn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 1.00
PIM1 P11309 6/20 0.53
PIM3 Q86V86 1/20 0.53
PIM2 Q9P1W9 1/20 0.53
CHEK1 O14757 1/20 0.46
ACHE P22303 1/20 0.46
MET P08581 1/20 0.44
CLK2 P49760 1/20 0.44
DYRK1A Q13627 1/20 0.44
ACVR1B P36896 1/20 0.44
TGFBR1 P36897 1/20 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
SCHEMBL1561284 0.90 MAPT (0.81) MAPTPIM1PIM3PIM2CHEK1
SCHEMBL17967635 0.79 MAPT (0.70) MAPTPIM1PIM3PIM2
SCHEMBL19269034 0.78 MAPT (0.69) MAPTPIM1CHEK1ACHE
SCHEMBL17967639 0.75 MAPT (1.00) MAPTCHEK1TGFBR1
Hydrochloric Acid SCHEMBL30669792 0.74 MAPT (0.58) MAPTPIM1PIM3PIM2MET
SCHEMBL17967657 0.73 MAPT (1.00) MAPT
SCHEMBL18440826 0.73 CLK2 (0.70) MAPTPIM1PIM3PIM2CLK2
SCHEMBL12666733 0.73 CHEK1 (0.69) MAPTPIM1PIM3PIM2CHEK1
SCHEMBL17592016 0.72 PIM1 (0.65) MAPTPIM1PIM3PIM2CLK2
SCHEMBL17967653 0.72 MAPT (1.00) MAPTMET

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
EP-3253762-B1 9H-PYRROLO-DIPYRIDINE DERIVATIVES UCB Biopharma SRL (BE) 2021-05-05 EP claimed
WO-2016124508-A1 9H-PYRROLO-DIPYRIDINE DERIVATIVES UCB BIOPHARMA SPRL (BE) 2016-08-11 WO claimed
EP-3253762-B1 9H-PYRROLO-DIPYRIDINE DERIVATIVES UCB Biopharma SRL (BE) 2021-05-05 EP disclosed
WO-2016124508-A1 9H-PYRROLO-DIPYRIDINE DERIVATIVES UCB BIOPHARMA SPRL (BE) 2016-08-11 WO disclosed