SCHEMBL31000090

SCHEMBL31000090

COc1cc(Cl)nnc1N1CCOCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
PDE10A Q9Y233 1/20 0.49
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
HPGD P15428 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP3A4 P08684 2/20 0.45
TSHR P16473 2/20 0.45
HSD17B10 Q99714 1/20 0.45
TRPM8 Q7Z2W7 2/20 0.43
LRRK2 Q5S007 1/20 0.43
KMT2A Q03164 1/20 0.43
GAK O14976 2/20 0.42
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL22042474 0.85 SMN1; SMN2 (0.46) SMN1; SMN2KDM4EALDH1A1HPGDKMT2A
SCHEMBL31092659 0.85 SMN1; SMN2 (0.46) SMN1; SMN2KDM4EALDH1A1HPGDKMT2A
SCHEMBL31000147 0.81 PIK3CA (0.50) SMN1; SMN2PDE10AKDM4EALDH1A1MAPT
SCHEMBL31000161 0.79 PDE5A (0.42) SMN1; SMN2ALDH1A1GAKLMNACNR2
SCHEMBL12002995 0.79 SUV39H2 (0.41) SMN1; SMN2ALDH1A1TSHRKMT2AGAK
SCHEMBL16094409 0.75 KMT2A (0.43) SMN1; SMN2KDM4EMAPTCYP2C19KMT2A
SCHEMBL31000267 0.75 ENPP1 (0.36) SMN1; SMN2ALDH1A1LMNA
SCHEMBL27186472 0.75 SMN1; SMN2 (0.53) SMN1; SMN2PDE10AKDM4EALDH1A1MAPT
SCHEMBL24328594 0.74 SMN1; SMN2 (0.46) SMN1; SMN2PDE10AKDM4EALDH1A1MAPT
SCHEMBL31000328 0.72 PRKDC (0.44) SMN1; SMN2PDE10AKDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4658659-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF Children's Hospital Medical Center (US) 2025-12-10 EP disclosed
WO-2025137567-A1 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2025-06-26 WO disclosed
WO-2024163764-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2024-08-08 WO disclosed