SCHEMBL31312450

SCHEMBL31312450

Nc1ccc2c(=O)c3ccc(N)cc3[nH]c2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.62
KIF11 P52732 2/20 0.53
CDK4 P11802 1/20 0.53
CCND1 P24385 1/20 0.53
AR P10275 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
GLA P06280 2/20 0.48
GAA P10253 2/20 0.48
HTT P42858 2/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
ATM Q13315 1/20 0.48
NPC1 O15118 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
GFER P55789 1/20 0.47
IMPDH2 P12268 1/20 0.42
CA12 O43570 1/20 0.42

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
SCHEMBL5332607 1.00 PARP1 (0.62) PARP1KIF11CDK4CCND1AR
SCHEMBL5335867 0.92 PARP1 (0.59) PARP1KIF11CDK4CCND1AR
SCHEMBL31473178 0.92 PARP1 (0.59) PARP1KIF11CDK4CCND1AR
SCHEMBL6325907 0.90 CDK4 (0.69) PARP1KIF11CDK4CCND1AR
SCHEMBL29683901 0.85 KIF11 (0.67) PARP1KIF11CDK4CCND1AR
SCHEMBL64877 0.85 KIF11 (0.67) PARP1KIF11CDK4CCND1AR
SCHEMBL2439209 0.83 CTSV (0.57) PARP1KIF11SMN1; SMN2ALDH1A1LMNA
SCHEMBL25791861 0.83 PARP1 (0.55) PARP1KIF11CDK4CCND1AR
SCHEMBL5342370 0.82 PARP1 (0.58) PARP1KIF11CDK4CCND1AR
SCHEMBL2435888 0.80 AR (0.53) PARP1KIF11CDK4CCND1AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120079270-A Inorganic atomic layer reinforced high-temperature-resistant nanofiltration membrane and preparation method and application thereof 浙江大学 2025-06-03 CN claimed
CN-119588179-B High-temperature-resistant nanofiltration membrane and preparation method thereof 湖南澳维科技股份有限公司 2025-06-17 CN disclosed
CN-120079270-A Inorganic atomic layer reinforced high-temperature-resistant nanofiltration membrane and preparation method and application thereof 浙江大学 2025-06-03 CN disclosed
CN-119241433-B Trisubstituted acridine derivative and preparation method and application thereof 温州医科大学附属第一医院 2025-03-25 CN disclosed
CN-119588179-A High-temperature-resistant nanofiltration membrane and preparation method thereof 湖南澳维科技股份有限公司 2025-03-11 CN disclosed
CN-119241433-A Trisubstituted acridine derivative and preparation method and application thereof 温州医科大学附属第一医院 2025-01-03 CN disclosed