SCHEMBL18178650

SCHEMBL18178650

CCC(=O)Oc1cccc(Cl)c1COc1cc(Cl)c(C)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 3/20 0.39
ACHE P22303 1/20 0.39
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.38
AKR1C3 P42330 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
MAPT P10636 1/20 0.37
SGMS2 Q8NHU3 1/20 0.37
PTGER1 P34995 1/20 0.37
PTGER4 P35408 1/20 0.37
PTGER3 P43115 1/20 0.37
PTGER2 P43116 1/20 0.37
NPC1 O15118 2/20 0.36
MEN1 O00255 1/20 0.36
MITF O75030 1/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
XBP1 P17861 1/20 0.36
NFKB1 P19838 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL18178719 0.94 KMT2A (0.41) MRGPRX4ACHEKMT2AALDH1A1NR1H4
SCHEMBL18530982 0.93 MAPT (0.40) MRGPRX4ACHEALDH1A1AKR1C3NR1H4
SCHEMBL18178651 0.93 SLC22A12 (0.41) MRGPRX4ACHEALDH1A1AKR1C3NR1H4
SCHEMBL18178692 0.91 MRGPRX4 (0.39) MRGPRX4ACHEMAPTNPC1MITF
SCHEMBL18178655 0.91 MRGPRX4 (0.42) MRGPRX4ACHEKMT2AALDH1A1MAPT
SCHEMBL18530987 0.91 PTGER1 (0.38) MRGPRX4ACHEKMT2AAKR1C3NR1H4
SCHEMBL18178654 0.90 MAPT (0.38) MRGPRX4ACHEALDH1A1AKR1C3NR1H4
SCHEMBL18178649 0.90 ACHE (0.36) MRGPRX4ACHEALDH1A1AKR1C3NR1H4
SCHEMBL18178662 0.90 MRGPRX4 (0.37) MRGPRX4ACHEAKR1C3NR1H4MAPT
SCHEMBL18178653 0.90 ALDH1A1 (0.39) MRGPRX4ACHEKMT2AALDH1A1MAPT

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 167/4885ACHE 460/4885KMT2A 2232/4885

“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.