SCHEMBL25812590

SCHEMBL25812590

NC(=O)c1cc(OCC#CCC2CCC2)c(Cl)c([N+](=O)[O-])c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 2/20 0.38
MAPT P10636 4/20 0.38
KMT2A Q03164 5/20 0.36
ALDH1A1 P00352 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
PARP15 Q460N3 1/20 0.35
PARP10 Q53GL7 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
GAA P10253 1/20 0.34
PKM P14618 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HCAR3 P49019 1/20 0.34
CTPS1 P17812 1/20 0.34
TP53 P04637 1/20 0.34
HTT P42858 1/20 0.34
PARP1 P09874 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL25812585 0.97 ALDH1A1 (0.39) LMNASMN1; SMN2POLBMAPTKMT2A
SCHEMBL25813018 0.91 LMNA (0.36) LMNASMN1; SMN2POLBMAPTKMT2A
SCHEMBL25813023 0.88 LMNA (0.38) LMNASMN1; SMN2POLBMAPTKMT2A
SCHEMBL25294461 0.84 GPR119 (0.39) MAPTPKMCTPS1TP53HTT
SCHEMBL25812567 0.83 ALDH1A1 (0.40) LMNASMN1; SMN2POLBMAPTKMT2A
SCHEMBL25301553 0.83 CHEK2 (0.41) MAPTKMT2AALDH1A1MEN1
SCHEMBL25291390 0.81 LMNA (0.35) LMNASMN1; SMN2POLBMAPTALDH1A1
SCHEMBL25298309 0.80 NR1D1 (0.40) MAPTPKMCTPS1TP53HTT
SCHEMBL30803074 0.79 PARP15 (0.46) LMNASMN1; SMN2POLBMAPTKMT2A
SCHEMBL28308732 0.79 PARP15 (0.46) LMNASMN1; SMN2POLBMAPTKMT2A

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-20230219931-A1 FUSED HETEROARYL HYDROXAMATES AS STING AGONISTS BISICHEM CO., LTD. (KR) 2023-07-13 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-20230219931-A1 FUSED HETEROARYL HYDROXAMATES AS STING AGONISTS STING1, IRF3, IFNAR1 LMNA 2977/4885SMN1; SMN2 3686/4885POLB 183/4885

“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.