SCHEMBL17832178

SCHEMBL17832178

COc1ccc(C(O)C(O)c2cc(O)cc(O)c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.55
TP53 P04637 1/20 0.55
MAPK1 P28482 1/20 0.55
CASP3 P42574 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
SENP8 Q96LD8 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
SENP6 Q9GZR1 1/20 0.55
PTGS1 P23219 2/20 0.52
PTGS2 P35354 2/20 0.52
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.52
CYP1A1 P04798 1/20 0.52
ALOX12 P18054 1/20 0.52
CYP1B1 Q16678 1/20 0.52
ADRB2 P07550 12/20 0.50
NQO2 P16083 1/20 0.46
LTA4H P09960 1/20 0.45
ESR2 Q92731 1/20 0.45

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
SCHEMBL19728201 0.85 CA1 (0.58) MAPK1LTA4HESR2
SCHEMBL3695690 0.85 CA1 (0.58) MAPK1LTA4HESR2
SCHEMBL11938486 0.85 CA1 (0.58) MAPK1LTA4HESR2
SCHEMBL11938484 0.85 CA1 (0.58) MAPK1LTA4HESR2
SCHEMBL19728209 0.85 CA1 (0.58) MAPK1LTA4HESR2
SCHEMBL17832179 0.85 TTR (0.50) NPC1TP53MAPK1RAB9ASMN1; SMN2
SCHEMBL16372699 0.81 TUBB4A (0.53) MAPK1
SCHEMBL16372528 0.81 ABL1 (0.55) NPC1MAPK1RAB9APTGS1PTGS2
SCHEMBL17832171 0.79 ESR1 (0.44) NPC1TP53MAPK1RAB9ASMN1; SMN2
SCHEMBL17832221 0.78 ACHE (0.44) LMNAADRB2BRD4

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-20170362152-A1 NOVEL 1,2-DIPHENYLETHYLENE GLYCOL COMPOUNDS FOR COMBATING AGING OF THE SKIN, AND COSMETIC USE THEREOF L'OREAL (FR) 2017-12-21 US disclosed
US-20170362152-A1 NOVEL 1,2-DIPHENYLETHYLENE GLYCOL COMPOUNDS FOR COMBATING AGING OF THE SKIN, AND COSMETIC USE THEREOF L'OREAL (FR) 2017-12-21 US disclosed
WO-2016092076-A1 NOVEL 1,2-DIPHENYLETHYLENE GLYCOL COMPOUNDS FOR COMBATING AGING OF THE SKIN, AND COSMETIC USE THEREOF L'OREAL (FR) 2016-06-16 WO 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-20170362152-A1 NOVEL 1,2-DIPHENYLETHYLENE GLYCOL COMPOUNDS FOR COMBATING AGING OF THE SKIN, AND COSMETIC USE THEREOF GLA, DSG1, GPX1 NPC1 1482/4885TP53 930/4885MAPK1 779/4885

“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.