SCHEMBL6806716

SCHEMBL6806716

CC(C)(C)[Si](C)(C)Oc1ccc(C2CCC(c3ccccc3NC(=O)O)CC2)c(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.41
HSD17B10 Q99714 2/20 0.40
IDO1 P14902 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
SYK P43405 1/20 0.35
LPAR1 Q92633 1/20 0.35
NPC1 O15118 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ATM Q13315 1/20 0.35
CREBBP Q92793 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA9 Q16790 1/20 0.34
DRD4 P21917 1/20 0.34
P2RY1 P47900 2/20 0.34
KCNH2 Q12809 1/20 0.34
TSHR P16473 1/20 0.33

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
SCHEMBL6434340 0.81 CA12 (0.39) HSP90AA1HSP90AB1NPC1RAB9ACA12
SCHEMBL6804889 0.81 FAAH (0.43) HSP90AA1HSP90AB1SMN1; SMN2
SCHEMBL6804882 0.81 FAAH (0.43) HSP90AA1HSP90AB1SMN1; SMN2
SCHEMBL7063726 0.80 NPC1 (0.47) NPC1RAB9ASMN1; SMN2
SCHEMBL7063724 0.80 NPC1 (0.47) NPC1RAB9ASMN1; SMN2
SCHEMBL7213965 0.79 CA12 (0.36) HSD17B10HSP90AA1HSP90AB1NPC1HTT
SCHEMBL7255762 0.78 KDM4E (0.35) HSP90AA1HSP90AB1NPC1SMN1; SMN2CREBBP
SCHEMBL7058684 0.78 KDM4E (0.35) HSP90AA1HSP90AB1NPC1SMN1; SMN2CREBBP
SCHEMBL7058680 0.78 KDM4E (0.35) HSP90AA1HSP90AB1NPC1SMN1; SMN2CREBBP
SCHEMBL6806711 0.78 HSP90AA1 (0.35) HSP90AA1HSP90AB1NPC1RAB9ASMN1; SMN2

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-6797731-B2 USE AS SKIN LIGHTENING AGENTS PFIZER INC. 2004-09-28 US disclosed
US-20030190298-A1 Resorcinol derivatives BRADLEY STUART E (GB) 2003-10-09 US disclosed
US-6541473-B2 Use as skin lightening agents; 4-(1,4-Dioxaspiro(4.5)dec-8-yl)-1,3-benzenediol for example WARNER LAMBERT COMPANY 2003-04-01 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-20030190298-A1 Resorcinol derivatives LRAT, NQO1, ALDH1A2 RIPK1 1637/4885HSD17B10 331/4885IDO1 3975/4885

“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.