SCHEMBL18514977

SCHEMBL18514977

CCc1ccc(OCc2c(NC(=S)OC)cccc2OC)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.42
HTT P42858 3/20 0.42
KMT2A Q03164 5/20 0.41
MEN1 O00255 3/20 0.41
KDM4E B2RXH2 2/20 0.41
NPC1 O15118 1/20 0.41
CASP3 P42574 1/20 0.41
RAB9A P51151 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 1/20 0.41
GAA P10253 4/20 0.39
MAPT P10636 1/20 0.39
ALOX12 P18054 1/20 0.39
PKM P14618 1/20 0.37

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
SCHEMBL18514931 0.94 ALDH1A1 (0.43) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL18515001 0.92 ALDH1A1 (0.38) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL18515006 0.90 KMT2A (0.38) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL18514930 0.90 TNKS2 (0.38) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL18515005 0.89 MAPT (0.38) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL18515004 0.89 KMT2A (0.35) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL18514978 0.89 SMN1; SMN2 (0.41) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL18514523 0.88 LMNA (0.47) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL18514231 0.88 KMT2A (0.41) LMNAHTTKMT2AMEN1KDM4E
SCHEMBL18514228 0.88 TAS1R3 (0.41) LMNAHTTKMT2AMEN1KDM4E

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 LMNA 2808/4885HTT 2020/4885KMT2A 705/4885
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-10 LMNA 3163/4885HTT 2506/4885KMT2A 1447/4885

“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.