SCHEMBL18178971

SCHEMBL18178971

CNC(=S)Oc1cccc(Br)c1COc1cc(C)c(C)cc1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
RAB9A P51151 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ALDH1A1 P00352 3/20 0.35
CYP1A2 P05177 1/20 0.34
SLC22A12 Q96S37 2/20 0.33
HPGD P15428 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TLR9 Q9NR96 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
LMNA P02545 2/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
STAT3 P40763 1/20 0.32
STAT1 P42224 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GALR3 O60755 1/20 0.31

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
SCHEMBL18182830 0.90 ALDH1A1 (0.34) MAPTRAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL18178974 0.89 SLC22A12 (0.40) MAPTRAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL18178850 0.88 MRGPRX4 (0.41) MAPTRAB9AALDH1A1CYP1A2HPGD
SCHEMBL18178941 0.86 MAPT (0.38) MAPTRAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL18179018 0.86 MAPT (0.36) MAPTRAB9ANPSR1ALDH1A1SLC22A12
SCHEMBL18178970 0.85 MAPT (0.37) MAPTRAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL18178966 0.85 ALDH1A1 (0.38) MAPTRAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL18178968 0.85 MRGPRX4 (0.37) MAPTRAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL18178978 0.85 MAPT (0.37) MAPTRAB9ANPSR1ALDH1A1CYP1A2
SCHEMBL18178963 0.85 MAPT (0.42) MAPTRAB9ANPSR1ALDH1A1CYP1A2

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 MAPT 4572/4885RAB9A 1136/4885NPSR1 930/4885

“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.