SCHEMBL18178216

SCHEMBL18178216

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

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 8/20 0.41
AR P10275 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NR3C1 P04150 1/20 0.37
NR3C2 P08235 1/20 0.37
SGMS2 Q8NHU3 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36
DHODH Q02127 1/20 0.36
MAPT P10636 1/20 0.36
RORC P51449 1/20 0.35

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
SCHEMBL18178410 0.93 MRGPRX4 (0.43) MRGPRX4RORC
SCHEMBL18178309 0.92 MRGPRX4 (0.42) MRGPRX4SMN1; SMN2ALDH1A1RAB9ARORC
SCHEMBL18178215 0.91 MRGPRX4 (0.39) MRGPRX4SGMS2RAB9AMAPTRORC
SCHEMBL18178214 0.91 MRGPRX4 (0.39) MRGPRX4
SCHEMBL18178615 0.90 MAPT (0.38) MRGPRX4ARALDH1A1POLBRAB9A
SCHEMBL18182833 0.90 MRGPRX4 (0.41) MRGPRX4ARSMN1; SMN2SGMS2ALDH1A1
SCHEMBL18178169 0.88 MRGPRX4 (0.40) MRGPRX4SMN1; SMN2SGMS2ALDH1A1POLB
SCHEMBL18178145 0.88 DHODH (0.40) MRGPRX4SMN1; SMN2SGMS2ALDH1A1POLB
SCHEMBL18178179 0.88 MRGPRX4 (0.42) MRGPRX4SMN1; SMN2SGMS2ALDH1A1POLB
SCHEMBL18178218 0.88 MRGPRX4 (0.38) MRGPRX4

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 MRGPRX4 167/4885AR 783/4885SMN1; SMN2 4166/4885

“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.