SCHEMBL29694584

SCHEMBL29694584

Cc1ccc(C2=CC(=O)C=CC2=O)cc1C

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.55
MAPT P10636 2/20 0.55
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.55
PKM P14618 1/20 0.55
MAPK1 P28482 1/20 0.55
KMT2A Q03164 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
HSD17B3 P37058 1/20 0.53
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
SETD7 Q8WTS6 10/20 0.47
PTPN11 Q06124 1/20 0.40
CCR6 P51684 1/20 0.38
HKDC1 Q2TB90 1/20 0.38
NOTUM Q6P988 1/20 0.38
BACE1 P56817 1/20 0.37
USP2 O75604 1/20 0.34
BRD4 O60885 1/20 0.33

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
SCHEMBL27485672 1.00 MCL1 (0.55) MCL1MAPTKDM4EMEN1PKM
SCHEMBL28146058 0.81 KDM4E (0.47) MCL1MAPTKDM4EMEN1PKM
SCHEMBL10882472 0.80 HSD17B3 (0.62) MCL1MAPTKDM4EMEN1PKM
SCHEMBL27169536 0.79 HSD17B3 (0.78) MCL1MAPTKDM4EMEN1PKM
SCHEMBL3786541 0.78 KDM4E (0.66) MCL1MAPTKDM4EMEN1PKM
SCHEMBL29273147 0.77 MEN1 (0.54) MCL1MAPTKDM4EMEN1PKM
SCHEMBL25834318 0.76 MAOB (0.60) MCL1MAPTKDM4EMEN1PKM
SCHEMBL6331662 0.74 MAOA (0.52) MCL1MAPTKDM4EMEN1PKM
SCHEMBL27909553 0.74 HSD17B3 (0.64) MCL1MAPTKDM4EMEN1PKM
SCHEMBL19657436 0.72 PTPN11 (0.46) MCL1MAPTKDM4EMEN1PKM

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
CN-114624174-A Method and device for testing oxidation resistance stability of high-temperature-resistant electrolyte membrane 中国科学院大连化学物理研究所 2022-06-14 CN disclosed