SCHEMBL15944452

SCHEMBL15944452

Cc1ccc(SCC2(C3CC(=O)C=C(O)C3)CC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.36
ALDH1A1 P00352 6/20 0.35
SMN1; SMN2 Q16637 5/20 0.34
HTT P42858 3/20 0.34
LMNA P02545 2/20 0.34
RAB9A P51151 5/20 0.33
NPC1 O15118 3/20 0.33
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
POLB P06746 2/20 0.32
HPGD P15428 2/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
ALOX12 P18054 1/20 0.31
HSD17B10 Q99714 1/20 0.31
EPHX2 P34913 1/20 0.31
CYP3A4 P08684 1/20 0.31
TP53 P04637 1/20 0.31
MAPK1 P28482 1/20 0.31
FKBP1A P62942 1/20 0.31

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
SCHEMBL15944451 0.73 ALDH1A1 (0.47) CRBNALDH1A1RAB9ANPC1MEN1
SCHEMBL14234215 0.72 HPGD (0.39) CRBNALDH1A1SMN1; SMN2LMNARAB9A
SCHEMBL15944266 0.72 ALDH1A1 (0.32) CRBNALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL15944434 0.70 MEN1 (0.39) CRBNALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL15944393 0.70 RAB9A (0.36) CRBNSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL15944406 0.65 HPGD (0.35) ALDH1A1SMN1; SMN2HTTLMNAMEN1
SCHEMBL15944448 0.65 ALDH1A1 (0.41) CRBNALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL31356794 0.64 POLB (0.70) ALDH1A1SMN1; SMN2HTTLMNARAB9A
SCHEMBL15455058 0.62 POLB (0.68) ALDH1A1SMN1; SMN2HTTLMNARAB9A
SCHEMBL15944449 0.60 ALDH1A1 (0.40) CRBNALDH1A1SMN1; SMN2HTTLMNA

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 CRBN 1417/4885ALDH1A1 1329/4885SMN1; SMN2 3708/4885
US-20150289505-A1 HERBICIDE COMPOSITION DDT, DHFR, DERL1 CRBN 530/4885ALDH1A1 215/4885SMN1; SMN2 4644/4885

“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.