SCHEMBL25848617

SCHEMBL25848617

CC(C)c1cc2cc(C(C)C)nn2c(C(C)C)n1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
KDM5B Q9UGL1 1/20 0.32
HRH3 Q9Y5N1 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
CRHBP P24387 1/20 0.31
CYP2C19 P33261 1/20 0.31
CRHR2 Q13324 1/20 0.31

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
SCHEMBL24995376 0.77 CCNT1 (0.40)
SCHEMBL20109750 0.67 PDE10A (0.32) NOS3NOS1NOS2ALDH1A1
SCHEMBL24759409 0.65 KDM5B (0.45) NOS3NOS1NOS2KDM5BHRH3
SCHEMBL24371169 0.65 HTR4 (0.42) ALDH1A1
SCHEMBL11652919 0.64 HTR4 (0.41) ALDH1A1
SCHEMBL6289321 0.62 KMT2A (0.33) NOS3NOS1NOS2ALDH1A1KMT2A
SCHEMBL24470101 0.62 PDE2A (0.38) NOS3NOS1NOS2KDM5BMEN1
SCHEMBL20088527 0.62 HTR4 (0.32)
SCHEMBL24175233 0.62 CCNT1 (0.40)
SCHEMBL24995358 0.62 ABL1 (0.36) NOS3NOS1NOS2KDM5B

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
US-11708369-B2 Heteroaromatic compounds having activity against RSV Janssen Sciences Ireland Unlimited Company (IE) 2023-07-25 US 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-11708369-B2 Heteroaromatic compounds having activity against RSV MAVS, ZC3HAV1, SARS1 NOS3 2970/4885NOS1 3162/4885NOS2 3070/4885

“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.