SCHEMBL18178059

SCHEMBL18178059

COC(=O)Oc1cccc(F)c1COc1ccc(C)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.49
DHODH Q02127 2/20 0.45
MAPT P10636 3/20 0.41
RAB9A P51151 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
NPC1 O15118 2/20 0.41
HPGD P15428 2/20 0.41
ATM Q13315 1/20 0.41
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PTGER1 P34995 2/20 0.40
FFAR1 O14842 1/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL18178045 0.90 MRGPRX4 (0.52) MRGPRX4DHODHMAPTALDH1A1PTGER1
SCHEMBL18178044 0.90 MRGPRX4 (0.52) MRGPRX4DHODHMAPTRAB9AL3MBTL1
SCHEMBL18178451 0.89 MRGPRX4 (0.49) MRGPRX4DHODHMAPTRAB9AL3MBTL1
SCHEMBL18178054 0.88 MRGPRX4 (0.51) MRGPRX4MAPTRAB9AL3MBTL1NPC1
SCHEMBL18178069 0.88 MRGPRX4 (0.47) MRGPRX4MAPTRAB9AL3MBTL1NPC1
SCHEMBL18178354 0.87 DHODH (0.41) MRGPRX4DHODHRAB9AALDH1A1SMN1; SMN2
SCHEMBL18181951 0.87 DHODH (0.43) MRGPRX4DHODHMAPTRAB9ANPC1
SCHEMBL18178047 0.86 MRGPRX4 (0.49) MRGPRX4MAPTRAB9AL3MBTL1NPC1
SCHEMBL18178051 0.86 MRGPRX4 (0.49) MRGPRX4DHODHMAPTRAB9AALDH1A1
SCHEMBL18178072 0.86 KDM4E (0.46) MRGPRX4MAPTRAB9AL3MBTL1NPC1

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 167/4885DHODH 4210/4885MAPT 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.