SCHEMBL13098461

SCHEMBL13098461

CCC(CC(C)c1ccc(O)cc1)c1ccc(OC(C)OCCOC(=O)c2cccs2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.43
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 3/20 0.39
MAPT P10636 3/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NFKB1 P19838 2/20 0.39
NFKB2 Q00653 2/20 0.39
RELA Q04206 2/20 0.39
PLA2G1B P04054 2/20 0.38
ATG4B Q9Y4P1 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
HPGD P15428 3/20 0.35
GLA P06280 1/20 0.35
BRCA1 P38398 1/20 0.35
LMNA P02545 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
SCHEMBL13098476 0.93 KMT2A (0.41) KMT2AALDH1A1MEN1NPC1MAPT
SCHEMBL13098482 0.93 KMT2A (0.40) KMT2AALDH1A1MEN1NPC1MAPT
SCHEMBL110492 0.87 KMT2A (0.51) KMT2AALDH1A1MEN1NPC1MAPT
SCHEMBL13098433 0.78 ESR1 (0.40) KMT2AALDH1A1MEN1MAPTTDP1
SCHEMBL13098459 0.78 ALDH1A1 (0.41) KMT2AALDH1A1MEN1MAPTSMN1; SMN2
SCHEMBL13098432 0.78 ESR1 (0.39) KMT2AALDH1A1MEN1NPC1MAPT
SCHEMBL13098457 0.77 ESR1 (0.38) KMT2AMEN1NFKB1PTGS1PTGS2
SCHEMBL13406748 0.77 DRD3 (0.38) KMT2AALDH1A1MEN1TDP1TSHR
SCHEMBL825421 0.77 DRD3 (0.38) KMT2AALDH1A1MEN1TDP1TSHR
SCHEMBL13098450 0.77 ALDH1A1 (0.41) KMT2AALDH1A1MEN1NPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7812194-B2 Positive photosensitive composition FUJIFILM CORPORATION (JP) 2010-10-12 US disclosed
US-20100255419-A1 POSITIVE PHOTOSENSITIVE COMPOSITION FUJIFILM CORPORATION (JP) 2010-10-07 US disclosed
US-7776512-B2 Positive photosensitive composition FUJIFILM CORPORATION (JP) 2010-08-17 US disclosed
US-20090148791-A1 POSITIVE PHOTOSENSITIVE COMPOSITION FUJIFILM CORPORATION (JP) 2009-06-11 US disclosed
US-7435526-B2 Positive photosensitive composition FUJIFILM CORPORATION (JP) 2008-10-14 US disclosed
US-20070003871-A1 Positive photosensitive composition FUJI PHOTO FILM CO., LTD. 2007-01-04 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-20100255419-A1 POSITIVE PHOTOSENSITIVE COMPOSITION RARA, SUN2, RARG KMT2A 1992/4885ALDH1A1 2704/4885MEN1 3334/4885

“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.