SCHEMBL18156500

SCHEMBL18156500

CCC(=O)Oc1ccccc1COc1ccc(CC)cc1Br

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 4/20 0.47
PDCD1 Q15116 1/20 0.47
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2D6 P10635 1/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
MAPT P10636 3/20 0.45
HPGD P15428 2/20 0.45
TP53 P04637 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 2/20 0.45
HSP90AA1 P07900 1/20 0.44
FFAR4 Q5NUL3 2/20 0.44
USP2 O75604 1/20 0.43
KMT2A Q03164 1/20 0.43
ALOX15 P16050 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL18182915 0.89 CD274 (0.47) CD274PDCD1CYP1A2CYP2C19CYP2D6
SCHEMBL18182426 0.89 ALOX15 (0.45) CD274FFAR4ALOX15
SCHEMBL18156124 0.88 CYP1A2 (0.45) CD274PDCD1CYP1A2CYP2C19CYP2D6
SCHEMBL18182548 0.86 FFAR4 (0.56) CD274FFAR4ALOX15
SCHEMBL18178465 0.86 MAPT (0.50) CD274PDCD1CYP1A2CYP2C19CYP2D6
SCHEMBL18156267 0.86 ALDH1A1 (0.44) CD274PDCD1NPC1RAB9AMAPT
SCHEMBL18156233 0.85 MRGPRX4 (0.46) CD274NPC1RAB9AHPGDTP53
SCHEMBL18156356 0.85 LMNA (0.46) CD274PDCD1MAPTHPGDSMN1; SMN2
SCHEMBL18178735 0.85 FFAR4 (0.43) CD274PDCD1NPC1RAB9AMAPT
SCHEMBL18182529 0.85 CYP1A2 (0.44) CD274PDCD1CYP1A2CYP2C19CYP2D6

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 3 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
EP-3081559-A1 AROMATIC COMPOUND AND APPLICATION FOR SAME Sumitomo Chemical Company, Limited (JP) 2016-10-19 EP 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 CD274 3579/4885PDCD1 2625/4885CYP1A2 647/4885

“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.