SCHEMBL18182002

SCHEMBL18182002

CCC(=O)Oc1cccc(Br)c1COc1cc(C)c(CC)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 5/20 0.36
ACHE P22303 1/20 0.35
MAPT P10636 1/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL18178723 0.92 MRGPRX4 (0.38) MRGPRX4ACHEMAPTKMT2AKDM4E
SCHEMBL18182595 0.91 MRGPRX4 (0.39) MRGPRX4MAPTLMNANPC1ALDH1A1
SCHEMBL18182960 0.90 PDCD1 (0.37) MRGPRX4LMNAFFAR4
SCHEMBL18182041 0.90 MRGPRX4 (0.40) MRGPRX4ACHEKMT2AKDM4ELMNA
SCHEMBL18156494 0.90 ACHE (0.37) MRGPRX4ACHEMAPTKMT2AKDM4E
SCHEMBL18182006 0.90 SLC22A12 (0.39) MRGPRX4ACHEMAPTKMT2AKDM4E
SCHEMBL18182264 0.90 KMT2A (0.38) MRGPRX4ACHEMAPTKMT2AKDM4E
SCHEMBL18182028 0.90 KMT2A (0.39) MRGPRX4ACHEKMT2AKDM4ELMNA
SCHEMBL18156317 0.90 FFAR4 (0.38) MRGPRX4ACHEMAPTKMT2AKDM4E
SCHEMBL18178654 0.89 MAPT (0.38) MRGPRX4ACHEMAPTKDM4ELMNA

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 460/4885MAPT 4572/4885

“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.