SCHEMBL1979380

SCHEMBL1979380

Cc1ccc2[nH]c3cnc(-c4cnn(C)c4)cc3c2c1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 15/20 0.58
MAPT P10636 3/20 0.52
PIM3 Q86V86 1/20 0.52
PIM2 Q9P1W9 1/20 0.52
ACHE P22303 2/20 0.50
CHEK1 O14757 1/20 0.50

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
SCHEMBL1978967 0.83 PIM1 (0.61) PIM1MAPTPIM3PIM2ACHE
SCHEMBL1980671 0.79 PIM1 (0.50) PIM1MAPTPIM3PIM2ACHE
SCHEMBL1979521 0.79 PIM1 (0.50) PIM1MAPTPIM3PIM2ACHE
SCHEMBL1561284 0.79 MAPT (0.81) PIM1MAPTPIM3PIM2ACHE
SCHEMBL1980500 0.78 PIM1 (0.49) PIM1MAPTPIM3PIM2ACHE
SCHEMBL1981543 0.78 PIM1 (0.49) PIM1MAPTPIM3PIM2ACHE
SCHEMBL1979823 0.78 PIM1 (0.48) PIM1MAPTPIM3PIM2ACHE
SCHEMBL12666733 0.77 CHEK1 (0.69) PIM1MAPTPIM3PIM2ACHE
SCHEMBL1987825 0.76 PIM1 (0.53) PIM1MAPTPIM3PIM2ACHE
SCHEMBL473684 0.75 CHEK1 (0.58) PIM1MAPTPIM3PIM2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011070298-A1 DI-SUBSTITUTED 9H-PYRIDO[3,4-B]INDOLE DERIVATIVES, PREPARATION OF SAME AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-06-16 WO disclosed