SCHEMBL4381582

SCHEMBL4381582

CCc1c(OCc2ccccc2)cc(OCc2ccccc2)c(-c2cccc(C)c2)c1CC(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.41
FFAR1 O14842 4/20 0.40
MRGPRX4 Q96LA9 3/20 0.39
PTGER1 P34995 3/20 0.39
PTGER4 P35408 1/20 0.39
PTGER3 P43115 1/20 0.39
PTGER2 P43116 1/20 0.39
FFAR4 Q5NUL3 1/20 0.38
CNR2 P34972 1/20 0.38
ICMT O60725 1/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL4380278 0.91 HPGD (0.42) PTGER1PTGER4PTGER3PTGER2NPC1
SCHEMBL4389711 0.83 CYP4F2 (0.41) LRRK2FFAR1MRGPRX4PTGER1PTGER4
SCHEMBL4385840 0.82 MAPT (0.39) LRRK2FFAR1MRGPRX4PTGER1PTGER4
SCHEMBL4383171 0.81 PTGER1 (0.48) FFAR1MRGPRX4PTGER1PTGER4PTGER3
SCHEMBL4379880 0.79 EGFR (0.42) NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL4386765 0.79 SMPD1 (0.44) LRRK2NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL4380214 0.79 SGMS2 (0.43) FFAR1MRGPRX4NPC1HPGDRAB9A
SCHEMBL4384794 0.78 PLA2G2A (0.41) PTGER1PTGER4PTGER3PTGER2NPC1
SCHEMBL4379731 0.78 ESR1 (0.38)
SCHEMBL8896993 0.76 MCL1 (0.47) LRRK2FFAR1MRGPRX4PTGER1PTGER4

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 LRRK2 1952/4885FFAR1 1445/4885MRGPRX4 1374/4885

“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.