SCHEMBL18514567

SCHEMBL18514567

CCc1cc(Cl)c(OCc2c(NC(=S)OC)cccc2OC)cc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.42
HTT P42858 3/20 0.42
GAA P10253 2/20 0.42
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPSR1 Q6W5P4 3/20 0.38
MAPT P10636 6/20 0.37
ALOX12 P18054 3/20 0.37
HPGD P15428 3/20 0.37
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
LMNA P02545 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
FGFR4 P22455 2/20 0.36
MAPK10 P53779 1/20 0.36
TP53 P04637 1/20 0.36
THRB P10828 1/20 0.35

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
SCHEMBL18514573 0.94 SMN1; SMN2 (0.38) ALDH1A1HTTGAAKDM4EMEN1
SCHEMBL18514575 0.93 KDM4E (0.38) ALDH1A1HTTGAAKDM4EMEN1
SCHEMBL18514572 0.93 ALDH1A1 (0.41) ALDH1A1HTTGAAKDM4EMEN1
SCHEMBL18514568 0.93 ALDH1A1 (0.38) ALDH1A1HTTGAAKDM4EMEN1
SCHEMBL18515420 0.90 ALDH1A1 (0.39) ALDH1A1HTTGAAKDM4EMEN1
SCHEMBL18514241 0.90 ALDH1A1 (0.39) ALDH1A1HTTGAAKDM4EMEN1
SCHEMBL18514566 0.90 ALDH1A1 (0.36) ALDH1A1HTTGAAKDM4EMEN1
SCHEMBL18514570 0.90 ALDH1A1 (0.36) ALDH1A1HTTGAAKDM4EMEN1
SCHEMBL18514574 0.90 ALDH1A1 (0.40) ALDH1A1HTTGAAKDM4EKMT2A
SCHEMBL18514798 0.89 ALDH1A1 (0.39) ALDH1A1HTTGAAKDM4ENPSR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9788547-B2 Aromatic compound and uses thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-17 US disclosed
US-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 US disclosed
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 US disclosed
EP-3130584-A1 AROMATIC COMPOUND AND USES THEREOF Sumitomo Chemical Company Limited (JP) 2017-02-15 EP 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 (2 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-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-0 ALDH1A1 1238/4885HTT 2020/4885GAA 3081/4885
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-10 ALDH1A1 1416/4885HTT 2506/4885GAA 3763/4885

“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.