SCHEMBL24925263

SCHEMBL24925263

C=C(OC)c1cc2n(n1)CCCC2=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.43
ALDH1A1 P00352 2/20 0.36
CYP2C19 P33261 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
POLB P06746 1/20 0.34
CYP2C9 P11712 1/20 0.34
PKM P14618 1/20 0.34
LMNA P02545 3/20 0.32
THRB P10828 1/20 0.32
TP53 P04637 3/20 0.31
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL19044281 0.84 CYP1A2 (0.49) CYP1A2ALDH1A1CYP2C19SMN1; SMN2MEN1
SCHEMBL25594845 0.82 CYP1A2 (0.44) CYP1A2ALDH1A1CYP2C19SMN1; SMN2MEN1
SCHEMBL1008113 0.77 CYP1A2 (0.48) CYP1A2ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL6381168 0.73 CYP1A2 (0.44) CYP1A2ALDH1A1CYP2C19SMN1; SMN2POLB
SCHEMBL6381453 0.71 ALDH1A1 (0.42) CYP1A2ALDH1A1CYP2C19SMN1; SMN2MEN1
SCHEMBL30926615 0.71 CYP1A2 (0.65) CYP1A2
SCHEMBL13423899 0.70 CYP1A2 (0.41) CYP1A2ALDH1A1
SCHEMBL13424047 0.68 CYP1A2 (0.48) CYP1A2ALDH1A1KDM4E
SCHEMBL31353905 0.68 PDCD1 (0.48)
SCHEMBL16285299 0.68 CYP1A2 (0.45) CYP1A2LMNAKDM4E

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-20230014226-A1 NEW COMPOUNDS AND METHODS BENEVOLENTAI BIO LIMITED (GB) 2023-01-19 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-20230014226-A1 NEW COMPOUNDS AND METHODS ABL2, ABL1, ALK CYP1A2 957/4885ALDH1A1 651/4885CYP2C19 620/4885

“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.