SCHEMBL18677457

SCHEMBL18677457

C=Cc1ccc(CN2C(=O)c3ccccc3C2O)c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.56
▸ LMNA P02545 1/20 0.56
▸ ALDH1A1 P00352 3/20 0.52
▸ PKM P14618 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ RAB9A P51151 3/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ KCNA5 P22460 4/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ TP53 P04637 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ SMN1; SMN2 Q16637 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
SCHEMBL18677458 0.89 HPGD (0.57) HPGDLMNAALDH1A1PKML3MBTL1
SCHEMBL14321143 0.76 CASP3 (0.43) HPGDALDH1A1PKMRAB9AMEN1
SCHEMBL19828935 0.74 HPGD (0.58) HPGDLMNAALDH1A1PKML3MBTL1
SCHEMBL20331972 0.73 HPGD (0.55) HPGDLMNAALDH1A1PKML3MBTL1
SCHEMBL19291862 0.73 HPGD (0.55) HPGDLMNAALDH1A1PKML3MBTL1
SCHEMBL1619264 0.71 HPGD (0.68) HPGDLMNAALDH1A1PKML3MBTL1
SCHEMBL29760295 0.71 HPGD (0.68) HPGDLMNAALDH1A1PKML3MBTL1
SCHEMBL6236827 0.71 HPGD (0.68) HPGDLMNAALDH1A1PKML3MBTL1
SCHEMBL18940682 0.70 KDM4E (0.43) HPGDALDH1A1RAB9AMEN1KMT2A
SCHEMBL22389412 0.69 L3MBTL1 (0.54) HPGDLMNAALDH1A1PKML3MBTL1

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-9615576-B2 Pesticidal compositions and processes related thereto DOW AGROSCIENCES LLC (US) 2017-04-11 — — US disclosed
US-20170088507-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2017-03-30 — — 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-20170088507-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS HPGD 1459/4885LMNA 2825/4885ALDH1A1 854/4885

“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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