SCHEMBL31305409

SCHEMBL31305409

Cc1[nH]c(Cc2cccc3ccccc23)nc1-c1cccc(Cl)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 3/20 0.48
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
ALDH1A1 P00352 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ADRA2A P08913 4/20 0.42
ADRA2B P18089 4/20 0.42
ADRA2C P18825 4/20 0.42
HTR6 P50406 2/20 0.40
EGFR P00533 1/20 0.39
ERBB2 P04626 1/20 0.39
CTRC Q99895 1/20 0.39
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38
ADRA1A P35348 3/20 0.37
ADRA1D P25100 2/20 0.37
ADRA1B P35368 2/20 0.37
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL3362520 1.00 P2RX7 (0.48) P2RX7LMNAMAPTALDH1A1KDM4E
SCHEMBL26112489 0.92 LMNA (0.44) P2RX7LMNAMAPTALDH1A1KDM4E
SCHEMBL2867291 0.91 KDM4E (0.48) P2RX7LMNAMAPTKDM4EADRA1A
SCHEMBL28805306 0.90 P2RX7 (0.43) P2RX7LMNAMAPTALDH1A1KDM4E
SCHEMBL28812708 0.90 P2RX7 (0.40) P2RX7LMNAMAPTKDM4EADRA1A
SCHEMBL26111203 0.87 LMNA (0.44) LMNAMAPTALDH1A1KDM4EADRA2A
SCHEMBL3359061 0.87 KDM4E (0.50) P2RX7LMNAMAPTALDH1A1KDM4E
SCHEMBL2870088 0.86 KDM4E (0.42) P2RX7LMNAMAPTKDM4EPOLB
SCHEMBL2872898 0.84 NR1H2 (0.48) P2RX7LMNAADRA1ACYP2D6MAPK1
SCHEMBL31305488 0.83 CRHR1 (0.43) LMNAMAPTALDH1A1KDM4EADRA2A

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-118922584-A Surface treating agent for copper or copper alloy 四国化成工业株式会社 2024-11-08 CN disclosed