SCHEMBL30795394

SCHEMBL30795394

Cn1cc(-c2cc(C=O)ccn2)cn1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACVR1B P36896 1/20 0.46
TGFBR1 P36897 1/20 0.46
PIM1 P11309 5/20 0.46
PIM3 Q86V86 1/20 0.44
PIM2 Q9P1W9 1/20 0.44
MAPT P10636 1/20 0.44
LRRK2 Q5S007 1/20 0.44
CCNC P24863 1/20 0.43
CDK8 P49336 1/20 0.43
KDM5B Q9UGL1 1/20 0.43
CSF1R P07333 1/20 0.43
ERN1 O75460 2/20 0.42
FGFR3 P22607 1/20 0.42
KDR P35968 1/20 0.42
CHEK1 O14757 1/20 0.41
EGFR P00533 2/20 0.41
MKNK1 Q9BUB5 2/20 0.40
ACVR1 Q04771 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
SCHEMBL21310765 1.00 ACVR1B (0.46) ACVR1BTGFBR1PIM1PIM3PIM2
SCHEMBL24316789 0.80 FYN (0.54) ACVR1BTGFBR1PIM1PIM3PIM2
SCHEMBL29539345 0.80 FYN (0.54) ACVR1BTGFBR1PIM1PIM3PIM2
SCHEMBL11983571 0.79 CCR1 (0.55) ACVR1BTGFBR1PIM1PIM3PIM2
SCHEMBL19925989 0.78 CYP11B1 (0.49) PIM1MAPTKDM5BERN1FGFR3
SCHEMBL31375150 0.78 CCNC (0.58) ACVR1BTGFBR1PIM1PIM3PIM2
SCHEMBL16561177 0.76 MKNK1 (0.51) ACVR1BTGFBR1PIM1PIM3PIM2
SCHEMBL20074520 0.76 AXL (0.51) ACVR1BTGFBR1PIM1PIM3PIM2
SCHEMBL23119645 0.76 FGFR3 (0.58) ACVR1BTGFBR1PIM1PIM3PIM2
SCHEMBL18397077 0.76 PIM1 (0.52) ACVR1BTGFBR1PIM1PIM3PIM2

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
EP-4584250-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS Biohaven Therapeutics Ltd. (VG) 2025-07-16 EP disclosed
WO-2024054811-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed