SCHEMBL4151993

SCHEMBL4151993

COC(=O)C(F)CN(C)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
TSHR P16473 2/20 0.46
OPRK1 P41145 1/20 0.46
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 4/20 0.46
BCHE P06276 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL13851512 0.87 ALDH1A1 (0.50) ACHESMN1; SMN2NPC1RAB9ATSHR
SCHEMBL84195 0.86 KMT2A (0.44) NPC1RAB9ATSHRALDH1A1L3MBTL1
SCHEMBL987913 0.86 KMT2A (0.44) NPC1RAB9ATSHRALDH1A1L3MBTL1
SCHEMBL10315708 0.86 KMT2A (0.44) NPC1RAB9ATSHRALDH1A1L3MBTL1
SCHEMBL25970364 0.83 OPRK1 (0.49) ACHESMN1; SMN2NPC1RAB9ATSHR
SCHEMBL7279699 0.79 ATM (0.54) NPC1RAB9AALDH1A1L3MBTL1MEN1
SCHEMBL1004393 0.78 L3MBTL1 (0.48) ACHESMN1; SMN2NPC1RAB9ATSHR
SCHEMBL1004392 0.78 L3MBTL1 (0.48) ACHESMN1; SMN2NPC1RAB9ATSHR
SCHEMBL1004394 0.78 L3MBTL1 (0.48) ACHESMN1; SMN2NPC1RAB9ATSHR
SCHEMBL25970360 0.77 ALDH1A1 (0.44) ACHESMN1; SMN2NPC1RAB9ATSHR

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-9023860-B2 Pro-drugs for controlled release of biologically active compounds SIGNATURE THERAPEUTICS, INC. (US) 2015-05-05 US disclosed
US-20090137618-A1 PRO-DRUGS FOR CONTROLLED RELEASE OF BIOLOGICALLY ACTIVE COMPOUNDS 3I, LP 2009-05-28 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-20090137618-A1 PRO-DRUGS FOR CONTROLLED RELEASE OF BIOLOGICALLY ACTIVE COMPOUNDS CRH, FURIN, PEPD ACHE 486/4885SMN1; SMN2 1019/4885NPC1 1492/4885

“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.