SCHEMBL18178640

SCHEMBL18178640

CCC(=O)Oc1cccc(C)c1COc1cc(Cl)c(C)cc1F

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.39
MRGPRX4 Q96LA9 7/20 0.37
ACHE P22303 1/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SGMS2 Q8NHU3 2/20 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
SCHEMBL18178638 0.93 ALDH1A1 (0.39) MRGPRX4ACHEMAPTKMT2AALDH1A1
SCHEMBL18178639 0.93 ALDH1A1 (0.39) MRGPRX4ACHEMAPTKMT2AALDH1A1
SCHEMBL18156505 0.91 MRGPRX4 (0.38) SLC22A12MRGPRX4ACHEMAPTLMNA
SCHEMBL18178646 0.91 MRGPRX4 (0.40) MRGPRX4ACHEMAPTALDH1A1
SCHEMBL18178644 0.91 ALDH1A1 (0.40) MRGPRX4ACHEMAPTLMNAKMT2A
SCHEMBL18178709 0.91 SLC22A12 (0.41) SLC22A12MRGPRX4ACHELMNAKMT2A
SCHEMBL18178641 0.90 MRGPRX4 (0.36) MRGPRX4ACHEMAPTLMNAALDH1A1
SCHEMBL18178642 0.90 MAPT (0.36) MRGPRX4ACHEMAPTLMNAALDH1A1
SCHEMBL18530977 0.90 SLC22A12 (0.43) SLC22A12MRGPRX4ACHEMAPTLMNA
SCHEMBL18178651 0.90 SLC22A12 (0.41) SLC22A12MRGPRX4ACHEMAPTLMNA

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 SLC22A12 4500/4885MRGPRX4 167/4885ACHE 460/4885

“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.