SCHEMBL6756012

SCHEMBL6756012

[CH2]CC(OCCCCCCCCCCCC)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LTA4H P09960 1/20 0.41
LMNA P02545 2/20 0.40
HTR2A P28223 1/20 0.40
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.39
KCNH2 Q12809 1/20 0.39
TP53 P04637 1/20 0.38
NAAA Q02083 2/20 0.38
PLA2G4B P0C869 1/20 0.37

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
SCHEMBL6539297 0.98 LTA4H (0.42) NPC1RAB9ASMN1; SMN2LTA4HLMNA
SCHEMBL6538486 0.87 NPC1 (0.41) NPC1RAB9ASMN1; SMN2LTA4HLMNA
SCHEMBL27396397 0.86 NPC1 (0.44) NPC1RAB9ASMN1; SMN2LTA4HLMNA
SCHEMBL28042470 0.85 NPC1 (0.43) NPC1RAB9ASMN1; SMN2LTA4HLMNA
SCHEMBL28042429 0.85 NPC1 (0.43) NPC1RAB9ASMN1; SMN2LTA4HLMNA
SCHEMBL28106834 0.85 NPC1 (0.43) NPC1RAB9ASMN1; SMN2LTA4HLMNA
SCHEMBL28042226 0.85 NPC1 (0.43) NPC1RAB9ASMN1; SMN2LTA4HLMNA
SCHEMBL28042424 0.85 NPC1 (0.43) NPC1RAB9ASMN1; SMN2LTA4HLMNA
SCHEMBL28042428 0.85 NPC1 (0.43) NPC1RAB9ASMN1; SMN2LTA4HLMNA
SCHEMBL28042227 0.85 NPC1 (0.43) NPC1RAB9ASMN1; SMN2LTA4HLMNA

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-6720421-B2 STORAGE STABILITY: GOOD RAW-STOCK STORABILITY BEFORE RECORDING AND GOOD IMAGE STORABILITY AFTER RECORDING FUJI PHOTO FILM CO., LTD. (JP) 2004-04-13 US disclosed
US-20030166961-A1 Phenylurethane compounds and methods for producing same, asymmetric urea compounds and methods for producing same, barbituric acid derivative, and diazo thermal recording material containing the derivative FUJI PHOTO FILM CO., LTD. 2003-09-04 US disclosed
US-20020161225-A1 Phenylurethane compounds and methods for producing same, asymmetric urea compounds and methods for producing same, barbituric acid derivative, and diazo thermal recording material containing the derivative FUJI PHOTO FILM CO., LTD. 2002-10-31 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-20030166961-A1 Phenylurethane compounds and methods for producing same, asymmetric urea compounds and methods for producing same, barbituric acid derivative, and diazo thermal recording material containing the derivative UROD, ATIC, DDC NPC1 3790/4885RAB9A 3725/4885SMN1; SMN2 1869/4885
US-20020161225-A1 Phenylurethane compounds and methods for producing same, asymmetric urea compounds and methods for producing same, barbituric acid derivative, and diazo thermal recording material containing the derivative UROD, ATIC, DDC NPC1 3790/4885RAB9A 3725/4885SMN1; SMN2 1869/4885

“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.