SCHEMBL4212157

SCHEMBL4212157

CS(=O)(=O)OCC1(COc2ccccc2)CCC1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 3/20 0.38
▸ MEN1 O00255 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ AR P10275 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ KCNA3 P22001 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MMP2 P08253 1/20 0.32
▸ MMP13 P45452 1/20 0.32
▸ ADAM17 P78536 1/20 0.32
▸ PKM P14618 1/20 0.32

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
SCHEMBL14671190 0.80 KDM4E (0.39) ALOX15ALDH1A1
SCHEMBL4902310 0.79 TACR1 (0.40) NPC1ARHPGDRAB9ASMN1; SMN2
SCHEMBL9577039 0.78 KCNA3 (0.43) RAB9AKCNA3ALDH1A1
SCHEMBL15538067 0.76 KDM4E (0.39) ALOX15ALDH1A1
SCHEMBL2350595 0.75 PPARD (0.45) KMT2AARALDH1A1
SCHEMBL2591925 0.74 KDM4E (0.37) ALOX15ALDH1A1
SCHEMBL4207677 0.74 ALDH1A1 (0.44) MEN1KMT2AALOX15KCNA3ALDH1A1
SCHEMBL4210725 0.74 TAAR1 (0.44) KCNA3ALDH1A1
SCHEMBL9370329 0.73 DPP4 (0.44) MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL9281344 0.73 TACR1 (0.42) MEN1KMT2ANPC1ARHPGD

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-20090131502-A1 Biologically active compounds QUIBELL MARTIN 2009-05-21 — — US disclosed
US-20090131502-A1 Biologically active compounds QUIBELL MARTIN 2009-05-21 — — US disclosed
WO-2007023281-A2 BIOLOGICALLY ACTIVE COMPOUNDS AMURA THERAPEUTICS LIMITED (GB) 2007-03-01 — — 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-20090131502-A1 Biologically active compounds COLGALT1, SOST, COL1A1 F2 1413/4885MEN1 185/4885HTT 375/4885

“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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