SCHEMBL30949503

SCHEMBL30949503

O=C(NC12CC(C1)C2)c1c(Br)ccc2[nH]ccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.44
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CNR1 P21554 1/20 0.38
FAAH O00519 1/20 0.38
POLB P06746 2/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
ALOX12 P18054 1/20 0.35
HTT P42858 1/20 0.35
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL30949539 0.74 CNR2 (0.36) CNR2CNR1FAAHHTR3EHTR3B
SCHEMBL30949552 0.72 DHPS (0.39) MEN1KMT2ANPC1RAB9AHTR3E
SCHEMBL30949607 0.72 POLB (0.43) CNR2MEN1KMT2ACNR1FAAH
SCHEMBL30949600 0.72 AHR (0.46) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL13987128 0.70 NR4A2 (0.47) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL3456991 0.66 CNR2 (0.56) CNR2MEN1KMT2AFAAHPOLB
SCHEMBL30949498 0.66 EPHX2 (0.38) CNR2MEN1KMT2ACNR1FAAH
SCHEMBL3459501 0.64 CNR2 (0.57) CNR2MEN1KMT2AFAAHPOLB
SCHEMBL30949599 0.61 P2RX7 (0.36)
SCHEMBL28305040 0.61 CNR2 (1.00) CNR2CNR1FAAHKDM4EALDH1A1

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-4652154-A1 NOVEL ALPK1 INHIBITORS Pyrotech (Beijing) Biotechnology Co., Ltd. (CN) 2025-11-26 EP disclosed
WO-2024153225-A1 NOVEL ALPK1 INHIBITORS PYROTECH (BEIJING) BIOTECHNOLOGY CO., LTD. (CN) 2024-07-25 WO disclosed