SCHEMBL15944277

SCHEMBL15944277

CCc1cc(C)cc(CC)c1C1=C(O)CC(CCCSc2ccc(C)cc2)CC1=O

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.34
NPC1 O15118 5/20 0.34
RAB9A P51151 4/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 4/20 0.33
HPGD P15428 5/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
KMT2A Q03164 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
MEN1 O00255 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
SCHEMBL14234190 0.94 ALDH1A1 (0.34) ALDH1A1NPC1RAB9AKDM4EMAPT
SCHEMBL14234994 0.90 ALOX5 (0.32)
SCHEMBL15944270 0.88 ALDH1A1 (0.33) ALDH1A1NPC1RAB9AMAPTHPGD
SCHEMBL15944363 0.88
SCHEMBL14234409 0.87
SCHEMBL15944292 0.87 ALDH1A1 (0.33) ALDH1A1NPC1RAB9AKDM4EMAPT
SCHEMBL14234810 0.87
SCHEMBL15944275 0.87 CRBN (0.36) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL14234827 0.86 MAPT (0.36) ALDH1A1NPC1RAB9AKDM4EMAPT
SCHEMBL14234193 0.86 MAOA (0.30)

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 1329/4885NPC1 4679/4885RAB9A 4307/4885
US-20150289505-A1 HERBICIDE COMPOSITION DDT, DHFR, DERL1 ALDH1A1 215/4885NPC1 4490/4885RAB9A 4799/4885

“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.