SCHEMBL30396183

SCHEMBL30396183

COC(=O)/C(=C\c1cc(OCc2ccccc2)ccc1Cl)N=[N+]=[N-]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.42
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ POLB P06746 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HIF1A Q16665 2/20 0.41
▸ MRGPRX4 Q96LA9 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAOB P27338 2/20 0.40
▸ NR1H4 Q96RI1 1/20 0.39
▸ BACE1 P56817 2/20 0.39
▸ ADCYAP1R1 P41586 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38

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
SCHEMBL30396596 0.92 ALDH1A1 (0.44) ALDH1A1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL30396850 0.85 SMN1; SMN2 (0.37) ALDH1A1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL24189544 0.85 SMN1; SMN2 (0.37) ALDH1A1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL29015520 0.85 SMN1; SMN2 (0.37) ALDH1A1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL27252480 0.81 CCNB2 (0.47) ALDH1A1MEN1KMT2AGAAL3MBTL1
SCHEMBL16303657 0.81 CCNB2 (0.47) ALDH1A1MEN1KMT2AGAAL3MBTL1
SCHEMBL30267904 0.79 POLB (0.34) ALDH1A1NPC1MEN1KMT2APOLB
SCHEMBL18990257 0.79 POLB (0.34) ALDH1A1NPC1MEN1KMT2APOLB
SCHEMBL18990256 0.79 POLB (0.34) ALDH1A1NPC1MEN1KMT2APOLB
SCHEMBL19343560 0.79 MAPT (0.40) ALDH1A1NPC1RAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11952365-B2 Anti-viral compounds ALIGOS THERAPEUTICS, INC. (US) 2024-04-09 — — US disclosed
EP-4165037-A1 ANTI-VIRAL COMPOUNDS FOR TREATING CORONAVIRUS, PICORNAVIRUS, AND NOROVIRUS INFECTIONS Aligos Therapeutics, Inc. (US) 2023-04-19 — — EP 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-11952365-B2 Anti-viral compounds EIF2AK2, ZC3HAV1, HAVCR2 ALDH1A1 2039/4885NPC1 34/4885RAB9A 347/4885

“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.

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