SCHEMBL18178053

SCHEMBL18178053

COC(=O)Oc1ccccc1COc1ccc(C)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 5/20 0.50
RAB9A P51151 4/20 0.47
NPC1 O15118 4/20 0.47
L3MBTL1 Q9Y468 4/20 0.47
MAPT P10636 3/20 0.47
HPGD P15428 3/20 0.47
ATM Q13315 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TP53 P04637 1/20 0.45
HTT P42858 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
FABP4 P15090 1/20 0.44
FABP5 Q01469 1/20 0.44
CD274 Q9NZQ7 3/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.44
KDM4E B2RXH2 2/20 0.43

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
SCHEMBL18178452 0.88 MRGPRX4 (0.50) MRGPRX4RAB9ANPC1L3MBTL1MAPT
SCHEMBL18138655 0.87 FFAR4 (0.49) MRGPRX4RAB9ANPC1L3MBTL1MAPT
SCHEMBL18178355 0.86 PTGDR2 (0.47) MRGPRX4NPC1HPGDTP53HTT
SCHEMBL18178078 0.86 KDM4E (0.50) L3MBTL1MAPTHPGDSMN1; SMN2HTT
SCHEMBL18178066 0.86 MRGPRX4 (0.49) MRGPRX4RAB9ANPC1L3MBTL1MAPT
SCHEMBL18156393 0.85 CD274 (0.47) MRGPRX4RAB9ANPC1MAPTHPGD
SCHEMBL18178263 0.85 PTGDR2 (0.46) MRGPRX4RAB9ANPC1HPGDTP53
SCHEMBL18178061 0.85 MAPT (0.50) RAB9ANPC1L3MBTL1MAPTHPGD
SCHEMBL18178111 0.85 MRGPRX4 (0.50) MRGPRX4L3MBTL1MAPTHPGDSMN1; SMN2
SCHEMBL18178048 0.85 MRGPRX4 (0.48) MRGPRX4RAB9ANPC1L3MBTL1MAPT

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 167/4885RAB9A 1136/4885NPC1 1520/4885

“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.