SCHEMBL18178466

SCHEMBL18178466

CCC(=O)Oc1cccc(Cl)c1COc1ccc(C)cc1Br

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.43
MAPT P10636 4/20 0.43
L3MBTL1 Q9Y468 4/20 0.43
TDP1 Q9NUW8 4/20 0.43
ABL1 P00519 1/20 0.42
RIN1 Q13671 1/20 0.42
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.41
PTGER1 P34995 1/20 0.41
PTGER4 P35408 1/20 0.41
PTGER3 P43115 1/20 0.41
PTGER2 P43116 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
GAA P10253 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL18178453 0.90 MRGPRX4 (0.52) HPGDMAPTL3MBTL1MRGPRX4PTGER1
SCHEMBL18178468 0.90 TDP1 (0.46) HPGDMAPTL3MBTL1TDP1ABL1
SCHEMBL18178122 0.89 MAPT (0.44) HPGDMAPTL3MBTL1TDP1ABL1
SCHEMBL18178479 0.88 MRGPRX4 (0.47) HPGDMAPTL3MBTL1TDP1MRGPRX4
SCHEMBL18178462 0.88 HPGD (0.45) HPGDMAPTL3MBTL1TDP1ABL1
SCHEMBL18182990 0.88 HSP90AA1 (0.44) HPGDMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL18178729 0.87 MRGPRX4 (0.38) HPGDMRGPRX4PTGER1PTGER4PTGER3
SCHEMBL18178471 0.87 MAPT (0.53) HPGDMAPTL3MBTL1TDP1ABL1
SCHEMBL18178487 0.87 PTGER1 (0.44) L3MBTL1MRGPRX4PTGER1PTGER4PTGER3
SCHEMBL18178464 0.87 HPGD (0.44) HPGDMAPTL3MBTL1TDP1ABL1

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 HPGD 4638/4885MAPT 4572/4885L3MBTL1 401/4885

“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.