SCHEMBL18178440

SCHEMBL18178440

CCC(=O)Oc1cccc(Cl)c1COc1ccc(C)cc1F

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 3/20 0.49
FFAR1 O14842 2/20 0.41
PTGER1 P34995 2/20 0.41
PTGER4 P35408 1/20 0.41
PTGER3 P43115 1/20 0.41
PTGER2 P43116 1/20 0.41
RAB9A P51151 1/20 0.41
MAPT P10636 1/20 0.40
ALDH1A1 P00352 2/20 0.39
MAPK14 Q16539 1/20 0.39
POLB P06746 1/20 0.39
DHODH Q02127 2/20 0.38

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) MRGPRX4PTGER1PTGER4PTGER3PTGER2
SCHEMBL18178443 0.90 MRGPRX4 (0.52) MRGPRX4FFAR1PTGER1
SCHEMBL18178051 0.89 MRGPRX4 (0.49) MRGPRX4FFAR1PTGER1PTGER4PTGER3
SCHEMBL18178479 0.88 MRGPRX4 (0.47) MRGPRX4FFAR1PTGER1PTGER4PTGER3
SCHEMBL18178444 0.88 MRGPRX4 (0.51) MRGPRX4FFAR1RAB9AMAPTALDH1A1
SCHEMBL18156349 0.88 FFAR1 (0.41) MRGPRX4FFAR1RAB9AMAPTALDH1A1
SCHEMBL18178446 0.87 MRGPRX4 (0.50) MRGPRX4FFAR1RAB9AMAPT
SCHEMBL18178445 0.87 MRGPRX4 (0.50) MRGPRX4FFAR1PTGER1PTGER4PTGER3
SCHEMBL18178716 0.87 ALDH1A1 (0.40) MRGPRX4RAB9AMAPTALDH1A1POLB
SCHEMBL18178487 0.87 PTGER1 (0.44) MRGPRX4FFAR1PTGER1PTGER4PTGER3

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 167/4885FFAR1 2736/4885PTGER1 4234/4885

“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.