SCHEMBL14929478

SCHEMBL14929478

CCC(C)C(=O)OCC(=O)OCC12CC3CC(C1)C(O)C(C3)C2

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
EPHX2 P34913 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL9924484 0.91 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL14929415 0.81 ALDH1A1 (0.36) ALDH1A1EPHX2
SCHEMBL14929480 0.80 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1EPHX2
SCHEMBL10189219 0.79 ALDH1A1 (0.57) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL14929423 0.79 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AL3MBTL1EPHX2
SCHEMBL13556148 0.78 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL14929457 0.78 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AL3MBTL1EPHX2
SCHEMBL18844973 0.76 ALDH1A1 (0.44) ALDH1A1MEN1KMT2AL3MBTL1CA12
SCHEMBL12705314 0.74 ALDH1A1 (0.48) ALDH1A1MEN1KMT2AL3MBTL1EPHX2
SCHEMBL14929544 0.73 ALDH1A1 (0.39) ALDH1A1KMT2AEPHX2LMNA

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-8790867-B2 Methods of forming photolithographic patterns by negative tone development ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2014-07-29 US disclosed
US-20130115559-A1 METHODS OF FORMING PHOTOLITHOGRAPHIC PATTERNS BY NEGATIVE TONE DEVELOPMENT ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2013-05-09 US disclosed