SCHEMBL5286663

SCHEMBL5286663

CC[n+]1cccc(C(C)C)c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 2/20 0.36
APOBEC3G Q9HC16 2/20 0.36
KDM4E B2RXH2 2/20 0.36
PKM P14618 1/20 0.36
KMT2A Q03164 1/20 0.35
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
TAAR1 Q96RJ0 2/20 0.30
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30
HTT P42858 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
SCHEMBL22922718 0.84 HDAC4 (0.39) APOBEC3AAPOBEC3GKDM4EPKMKMT2A
SCHEMBL5328558 0.84 HTT (0.39) KDM4EMAOAMAOBGRIN1GRIN2A
SCHEMBL15698317 0.82 GGPS1 (0.34) APOBEC3AAPOBEC3GKMT2A
SCHEMBL5304636 0.81 HTT (0.47) LMNAHTT
SCHEMBL5328409 0.80 HTT (0.54) KMT2ALMNATSHRHTT
SCHEMBL5415294 0.78 HTT (0.57) KMT2ALMNATSHRHTT
SCHEMBL5292514 0.78 HTT (0.57) KMT2ALMNATSHRHTT
SCHEMBL5327048 0.78 HTT (0.57) KMT2ALMNATSHRHTT
SCHEMBL5330063 0.78 HTT (0.57) KMT2ALMNATSHRHTT
SCHEMBL5324627 0.78 HTT (0.57) KMT2ALMNATSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210024499-A1 OXIDIZED BIS(3-INDOLYL)METHANES AND USES THEREOF XIAMEN UNIVERSITY (CN) 2021-01-28 US disclosed
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 WO 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-20210024499-A1 OXIDIZED BIS(3-INDOLYL)METHANES AND USES THEREOF BCL2, BCOR, BCLAF1 APOBEC3A 4308/4885APOBEC3G 3986/4885KDM4E 3932/4885

“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.