SCHEMBL13624925

SCHEMBL13624925

CC(=O)Nc1ccc(/C=C\CCCCC[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPT P10636 3/20 0.48
MEN1 O00255 2/20 0.48
MAPK1 P28482 1/20 0.48
NAMPT P43490 1/20 0.44
PPARG P37231 1/20 0.44
SOAT2 O75908 1/20 0.43
SOAT1 P35610 1/20 0.43
HDAC1 Q13547 1/20 0.43
MAOB P27338 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
NOX1 Q9Y5S8 1/20 0.42
NAPRT Q6XQN6 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
POLB P06746 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
PSMB11 A5LHX3 1/20 0.40

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
SCHEMBL13624924 0.79 MAPT (0.47) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL4291294 0.79 MAPT (0.47) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL4291297 0.79 MAPT (0.47) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL13624918 0.78 MAPT (0.46) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL4293602 0.78 MAPT (0.46) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL4293600 0.78 MAPT (0.46) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL4296650 0.75 PPARG (0.44) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL4296655 0.75 PPARG (0.44) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL28208686 0.73 RAB9A (0.71) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL14384399 0.73 RAB9A (0.71) NPC1RAB9AKMT2AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275664-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES PROGEN PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20080194697-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES CELLGATE, INC. 2008-08-14 US disclosed
US-7279502-B2 Polyamine analog conjugates and quinone conjugates as therapies for cancers and prostate diseases CELLGATE, INC. (US) 2007-10-09 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 (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-20080194697-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES CTSB, KLK3, FOLH1 NPC1 1214/4885RAB9A 1313/4885KMT2A 1702/4885
US-20090275664-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES CTSB, CTSL, CTSV NPC1 1519/4885RAB9A 1201/4885KMT2A 2180/4885

“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.