SCHEMBL15944448

SCHEMBL15944448

Cc1ccc(SCC2(CO)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
HTT P42858 2/20 0.40
LMNA P02545 2/20 0.40
CRBN Q96SW2 1/20 0.40
RAB9A P51151 5/20 0.39
NPC1 O15118 3/20 0.39
HPGD P15428 2/20 0.37
MAPK1 P28482 2/20 0.36
TP53 P04637 1/20 0.36
FKBP1A P62942 1/20 0.36
CYP3A4 P08684 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL14234229 0.77 PPARD (0.45) ALDH1A1LMNACRBNCYP3A4
SCHEMBL10862531 0.71 HPGD (0.47) ALDH1A1SMN1; SMN2RAB9ANPC1HPGD
SCHEMBL27501 0.69 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2HTTLMNACRBN
SCHEMBL15944449 0.69 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2HTTLMNACRBN
SCHEMBL28013233 0.68 RAB9A (0.43) ALDH1A1SMN1; SMN2HTTLMNARAB9A
SCHEMBL1710073 0.67 NPC1 (0.52) ALDH1A1SMN1; SMN2HTTLMNARAB9A
SCHEMBL1119060 0.66 RAB9A (0.45) ALDH1A1SMN1; SMN2CRBNRAB9ANPC1
SCHEMBL31447792 0.66 RAB9A (0.45) ALDH1A1SMN1; SMN2HTTCRBNRAB9A
SCHEMBL5168911 0.65 NPC1 (0.65) ALDH1A1RAB9ANPC1HPGDMAPK1
SCHEMBL19798033 0.65 NPC1 (0.48) ALDH1A1SMN1; SMN2CRBNRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9414588-B2 Herbicide composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-16 US disclosed
US-20150289505-A1 HERBICIDE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-15 US disclosed
US-9101140-B2 Cyclohexanone compounds and herbicides comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-08-11 US disclosed
US-20140228219-A1 CYCLOHEXANONE COMPOUNDS AND HERBICIDES COMPRISING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-14 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 (2 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-20140228219-A1 CYCLOHEXANONE COMPOUNDS AND HERBICIDES COMPRISING THE SAME CBR3, CBR1, CYP2S1 ALDH1A1 1329/4885SMN1; SMN2 3708/4885HTT 3503/4885
US-20150289505-A1 HERBICIDE COMPOSITION DDT, DHFR, DERL1 ALDH1A1 215/4885SMN1; SMN2 4644/4885HTT 750/4885

“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.