SCHEMBL18178920

SCHEMBL18178920

CCC(=S)Oc1cccc(CO)c1COc1ccc(C)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.41
L3MBTL1 Q9Y468 4/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
HSP90AA1 P07900 1/20 0.36
UBE2N P61088 1/20 0.36
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
FFAR4 Q5NUL3 2/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL18178921 0.92 MRGPRX4 (0.44) MRGPRX4L3MBTL1SMN1; SMN2NPC1RAB9A
SCHEMBL18178922 0.90 MRGPRX4 (0.40) MRGPRX4L3MBTL1SMN1; SMN2NPC1RAB9A
SCHEMBL18178896 0.88 MRGPRX4 (0.43) MRGPRX4L3MBTL1SMN1; SMN2NPC1RAB9A
SCHEMBL18179042 0.88 MAPT (0.34) MRGPRX4RAB9AMAPTCD274
SCHEMBL18178917 0.88 MRGPRX4 (0.44) MRGPRX4L3MBTL1SMN1; SMN2NPC1RAB9A
SCHEMBL18178485 0.86 MRGPRX4 (0.46) MRGPRX4L3MBTL1SMN1; SMN2NPC1RAB9A
SCHEMBL18178823 0.86 MRGPRX4 (0.41) MRGPRX4L3MBTL1SMN1; SMN2NPC1RAB9A
SCHEMBL18178919 0.86 MRGPRX4 (0.43) MRGPRX4L3MBTL1SMN1; SMN2NPC1RAB9A
SCHEMBL18178853 0.85 MRGPRX4 (0.40) MRGPRX4L3MBTL1SMN1; SMN2NPC1RAB9A
SCHEMBL18178915 0.85 MRGPRX4 (0.42) MRGPRX4L3MBTL1SMN1; SMN2NPC1RAB9A

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 167/4885L3MBTL1 401/4885SMN1; SMN2 4166/4885

“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.