SCHEMBL18178451

SCHEMBL18178451

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

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 4/20 0.49
MAPT P10636 2/20 0.43
RAB9A P51151 2/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
DHODH Q02127 2/20 0.42
KDM4E B2RXH2 1/20 0.41
PTGER1 P34995 1/20 0.40
ALDH1A1 P00352 2/20 0.39
FFAR1 O14842 1/20 0.39
POLB P06746 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
SCHEMBL18178453 0.90 MRGPRX4 (0.52) MRGPRX4MAPTRAB9AATML3MBTL1
SCHEMBL18178443 0.90 MRGPRX4 (0.52) MRGPRX4PTGER1FFAR1
SCHEMBL18178059 0.89 MRGPRX4 (0.49) MRGPRX4MAPTRAB9AATML3MBTL1
SCHEMBL18178458 0.88 MRGPRX4 (0.51) MRGPRX4MAPTRAB9AATML3MBTL1
SCHEMBL18178481 0.88 MRGPRX4 (0.47) MRGPRX4MAPTRAB9AL3MBTL1ALDH1A1
SCHEMBL18156234 0.88 DHODH (0.42) MRGPRX4MAPTRAB9ADHODHALDH1A1
SCHEMBL18178748 0.87 ALDH1A1 (0.40) MAPTRAB9AATMDHODHALDH1A1
SCHEMBL18178457 0.87 RAB9A (0.53) MRGPRX4MAPTRAB9AATML3MBTL1
SCHEMBL18178460 0.87 MRGPRX4 (0.50) MRGPRX4MAPTRAB9AATML3MBTL1
SCHEMBL18178494 0.87 MRGPRX4 (0.42) MRGPRX4MAPTL3MBTL1KDM4EPTGER1

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 167/4885MAPT 4572/4885RAB9A 1136/4885

“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.