SCHEMBL21889830

SCHEMBL21889830

CC(C)CN(CCOCCOCCN(CC(C)C)CC(C)C)CC(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
HSD17B10 Q99714 1/20 0.39
PIK3CD O00329 1/20 0.39
CYP1A2 P05177 1/20 0.37
MAPK1 P28482 1/20 0.37
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL14980564 0.80 HSD17B10 (0.41) BLMPMP22HSD17B10CA12CA1
SCHEMBL20438513 0.79 OPRM1 (0.35) BLMPMP22HSD17B10PIK3CDMEN1
SCHEMBL19554740 0.79 ALDH1A1 (0.37) BLMPMP22HSD17B10PIK3CDCA12
SCHEMBL20445520 0.78 PIK3CD (0.33) PIK3CD
SCHEMBL20438697 0.77 BLM (0.33) BLMPMP22HSD17B10PIK3CDMEN1
SCHEMBL11816356 0.77 PIK3CD (0.38) PIK3CDCYP1A2MAPK1CA12CA1
SCHEMBL20438708 0.77 HSD17B10 (0.38) BLMPMP22HSD17B10MEN1POLB
SCHEMBL20445521 0.77 PIK3CD (0.32) PIK3CD
SCHEMBL23634754 0.77 MEN1 (0.41) PIK3CDCYP1A2MAPK1MEN1POLB
SCHEMBL15016045 0.76 CYP1A2 (0.48) PIK3CDCYP1A2MAPK1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10590264-B2 Photopolymerization initiator, polymerizable composition, ink jet recording method, and acylphosphine oxide compound FUJIFILM CORPORATION (JP) 2020-03-17 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-10590264-B2 Photopolymerization initiator, polymerizable composition, ink jet recording method, and acylphosphine oxide compound CCNT1, CDK1, CCNB1 BLM 2972/4885PMP22 3029/4885HSD17B10 3572/4885

“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.