SCHEMBL18156097

SCHEMBL18156097

CCc1ccc(OCc2c(C)cccc2OC(=O)OC)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.43
MAPT P10636 3/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SLC22A12 Q96S37 1/20 0.43
MRGPRX4 Q96LA9 5/20 0.41
NPC1 O15118 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41
XBP1 P17861 1/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CD274 Q9NZQ7 7/20 0.41
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
TAS1R2 Q8TE23 1/20 0.40
MAPK10 P53779 1/20 0.40
HPGD P15428 2/20 0.39
PDK2 Q15119 1/20 0.39

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
SCHEMBL18156391 0.91 MRGPRX4 (0.43) RAB9AMAPTMRGPRX4NPC1SMN1; SMN2
SCHEMBL18156409 0.90 SLC22A12 (0.44) RAB9AMAPTLMNAL3MBTL1SLC22A12
SCHEMBL18182922 0.90 MRGPRX4 (0.43) RAB9AMAPTMRGPRX4NPC1SMN1; SMN2
SCHEMBL18182919 0.90 NPC1 (0.45) RAB9AMAPTLMNAMRGPRX4NPC1
SCHEMBL18182357 0.90 LMNA (0.45) RAB9AMAPTLMNAL3MBTL1SLC22A12
SCHEMBL18156202 0.89 RORC (0.45) RAB9AMAPTLMNAMRGPRX4NPC1
SCHEMBL18156189 0.89 L3MBTL1 (0.44) RAB9AMAPTLMNAL3MBTL1SLC22A12
SCHEMBL18156096 0.88 MRGPRX4 (0.41) RAB9AMAPTMRGPRX4NPC1SMN1; SMN2
SCHEMBL18181951 0.88 DHODH (0.43) RAB9AMAPTMRGPRX4NPC1SMN1; SMN2
SCHEMBL18181950 0.88 MRGPRX4 (0.41) RAB9AMAPTMRGPRX4NPC1SMN1; SMN2

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-9573904-B2 Aromatic compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-21 US disclosed
US-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-10-27 US disclosed
EP-3081559-A1 AROMATIC COMPOUND AND APPLICATION FOR SAME Sumitomo Chemical Company, Limited (JP) 2016-10-19 EP 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-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF ZCCHC8, CBR3, CBX8 RAB9A 1136/4885MAPT 4572/4885LMNA 4171/4885

“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.