SCHEMBL18178274

SCHEMBL18178274

COC(=O)Oc1cccc(F)c1COc1cc(Cl)c(C)cc1C

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.40
ALDH1A1 P00352 3/20 0.39
RAB9A P51151 2/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
DHODH Q02127 2/20 0.38
PPARD Q03181 1/20 0.38
PTGER1 P34995 1/20 0.38
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GUCY1B2 O75343 1/20 0.37
GUCY1A2 P33402 1/20 0.37
GUCY1A1 Q02108 1/20 0.37
GUCY1B1 Q02153 1/20 0.37

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
SCHEMBL18178243 0.93 SGMS2 (0.41) SGMS2MRGPRX4ALDH1A1RAB9APOLB
SCHEMBL18178254 0.93 SGMS2 (0.41) SGMS2MRGPRX4ALDH1A1RAB9APOLB
SCHEMBL18178381 0.91 MRGPRX4 (0.43) MRGPRX4RAB9ALMNAKDM4ENPSR1
SCHEMBL18178289 0.90 ALDH1A1 (0.39) SGMS2MRGPRX4ALDH1A1RAB9APOLB
SCHEMBL18178262 0.90 SGMS2 (0.39) SGMS2ALDH1A1RAB9APOLBSMN1; SMN2
SCHEMBL18182376 0.90 ALDH1A1 (0.39) SGMS2MRGPRX4ALDH1A1RAB9APOLB
SCHEMBL18178278 0.90 SLC22A12 (0.43) SGMS2MRGPRX4ALDH1A1RAB9APOLB
SCHEMBL18178275 0.90 KDM4E (0.40) SGMS2MRGPRX4ALDH1A1RAB9APOLB
SCHEMBL18178175 0.90 MRGPRX4 (0.44) MRGPRX4RAB9ALMNAKDM4ENPSR1
SCHEMBL18178297 0.89 SGMS2 (0.39) SGMS2ALDH1A1RAB9APOLBSMN1; 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 2 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

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 SGMS2 1962/4885MRGPRX4 167/4885ALDH1A1 3176/4885

“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.