SCHEMBL28599216

SCHEMBL28599216

CC(C)(C)P(=O)(c1ccnn1-c1c(-c2ccccc2)nn(-c2ccccc2)c1-c1ccccc1)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP1A2 P05177 1/20 0.37
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
ALDH1A1 P00352 3/20 0.34
CCNA2 P20248 2/20 0.34
CDK2 P24941 2/20 0.34
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
LMNA P02545 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PTGER1 P34995 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
SCHEMBL407721 0.81 ALDH1A1 (0.38) MEN1KMT2ACYP2C9CYP2C19CYP1A2
SCHEMBL12930022 0.77 CYP2C9 (0.43) MEN1KMT2ACYP2C9CYP2C19CYP1A2
SCHEMBL28924190 0.77 MEN1 (0.36) MEN1KMT2ACYP2C9CYP2C19CYP1A2
SCHEMBL140011 0.76 CA1 (0.37) MEN1KMT2ACYP2C9CYP2C19CYP1A2
SCHEMBL18802300 0.76 CA1 (0.37) MEN1KMT2ACYP2C9CYP2C19CYP1A2
SCHEMBL18806835 0.76 CA1 (0.37) MEN1KMT2ACYP2C9CYP2C19CYP1A2
SCHEMBL11998814 0.75 CA1 (0.34) MEN1KMT2ACYP2C9CYP2C19CYP1A2
SCHEMBL409808 0.75 CA1 (0.41) MEN1KMT2ACYP2C9CYP2C19CYP1A2
SCHEMBL10227709 0.74 CCNA2 (0.40) MEN1KMT2ACYP2C9CYP2C19CYP1A2
SCHEMBL29196807 0.74 CA1 (0.35) MEN1KMT2ACYP2C9CYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250084062-A1 SUBSTITUTED QUINOLINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2025-03-13 US disclosed
CN-113166151-A Substituted xanthine derivatives 勃林格殷格翰国际有限公司 2021-07-23 CN disclosed
CN-108884093-B Dopamine D3 ligand compound 辉瑞公司 2021-07-09 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250084062-A1 SUBSTITUTED QUINOLINE DERIVATIVE CHRNA4, CHRNA2, CHRNA5 MEN1 3349/4885KMT2A 2084/4885CYP2C9 3729/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.