SCHEMBL30712341

SCHEMBL30712341

Cc1sc(N2CCCNC2=O)nc1Br

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.31
PIM1 P11309 1/20 0.31
PIM3 Q86V86 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL31741937 0.74 SMN1; SMN2 (0.34) SMN1; SMN2CYP1A2CYP3A4TSHRHSD17B10
SCHEMBL4025720 0.72 PIK3CD (0.51) SMN1; SMN2TSHRL3MBTL1MAPT
SCHEMBL31490429 0.71 L3MBTL1 (0.63) SMN1; SMN2CYP1A2CYP3A4TSHRHSD17B10
SCHEMBL243814 0.68 ALDH1A1 (0.53) SMN1; SMN2CYP1A2HSD17B10MAPT
SCHEMBL6545710 0.65 ADORA3 (0.41) CYP3A4HSD17B10PIM1PIM3PIM2
SCHEMBL18282490 0.64 CYP1A2 (0.47) SMN1; SMN2CYP1A2CYP3A4TSHRHSD17B10
SCHEMBL28461986 0.64 KMT2A (0.47) SMN1; SMN2CYP1A2CYP3A4TSHRHSD17B10
SCHEMBL10200659 0.63 PIM1 (0.45) SMN1; SMN2PIM1PIM3PIM2
SCHEMBL244427 0.63 SCD (0.40) SMN1; SMN2CYP1A2CYP3A4TSHRHSD17B10
SCHEMBL4023755 0.63 PIK3CD (0.54) SMN1; SMN2CYP1A2CYP3A4TSHRHSD17B10

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-4540247-A1 MULTI-KINASE INHIBITORS, COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME BIOFRONT LTD (KY) 2025-04-23 EP disclosed
CN-119032093-A Multi-kinase inhibitors, compositions and methods of use 百放开曼有限公司 2024-11-26 CN disclosed
WO-2023246491-A1 MULTI-KINASE INHIBITORS, COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME BIOFRONT LTD (KY) 2023-12-28 WO disclosed
WO-2023245329-A1 MULTI-KINASE INHIBITORS, COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME BIOFRONT LTD (KY) 2023-12-28 WO disclosed