SCHEMBL4384794

SCHEMBL4384794

CCc1c(OCc2ccccc2)cc(OCc2ccccc2)c(-c2ccccc2)c1CC(=O)NN

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 7/20 0.41
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
PTGER1 P34995 1/20 0.39
PTGER4 P35408 1/20 0.39
PTGER3 P43115 1/20 0.39
PTGER2 P43116 1/20 0.39
BRD4 O60885 1/20 0.39
P2RX4 Q99571 1/20 0.39
CFD P00746 1/20 0.38
PLG P00747 1/20 0.38
PLAU P00749 1/20 0.38
F11 P03951 1/20 0.38
KLKB1 P03952 1/20 0.38
F7 P08709 1/20 0.38
TPSB2 P20231 1/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL4383171 0.87 PTGER1 (0.48) PTGER1PTGER4PTGER3PTGER2BRD4
SCHEMBL4379399 0.86 ALDH1A1 (0.44) PLA2G2AKDM4EALDH1A1MAPTHDAC6
SCHEMBL4380278 0.86 HPGD (0.42) KDM4EALDH1A1HDAC6PTGER1PTGER4
SCHEMBL4381086 0.83 ALDH1A1 (0.42) ALDH1A1RAB9A
SCHEMBL4383989 0.82 YAP1 (0.41) ALDH1A1RAB9A
SCHEMBL4381582 0.78 LRRK2 (0.41) PTGER1PTGER4PTGER3PTGER2NPC1
SCHEMBL4382835 0.78 CYP4F2 (0.43) MAPTNPC1HPGDRAB9ASMN1; SMN2
SCHEMBL4389605 0.78 HPGD (0.39) KDM4EMAPTHDAC6PTGER1BRD4
SCHEMBL4385645 0.77 MAPK14 (0.41) KDM4EMAPTPTGER1PTGER4PTGER3
SCHEMBL4384766 0.74 HMGCR (0.41) MAPTPTGER1PTGER4PTGER3PTGER2

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-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 EP 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-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P PLA2G2A 4861/4885KDM4E 3223/4885ALDH1A1 3520/4885

“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.