SCHEMBL15375111

SCHEMBL15375111

CC(=O)OCCCCCCCCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
LMNA P02545 2/20 0.39
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
TSHR P16473 4/20 0.38
DUT P33316 1/20 0.37
CHRM5 P08912 2/20 0.35
CHRM1 P11229 2/20 0.35
CHRM3 P20309 2/20 0.35
PGR P06401 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
HTR1A P08908 1/20 0.35
CHRNB2 P17787 1/20 0.35
TBXA2R P21731 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 1/20 0.35
CHRNA4 P43681 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL16696044 0.98 ALDH1A1 (0.47) ALDH1A1LMNAAPOBEC3AAPOBEC3GTSHR
SCHEMBL27163160 0.91 LMNA (0.38) ALDH1A1LMNAAPOBEC3AAPOBEC3GSMN1; SMN2
SCHEMBL28704916 0.84 TSHR (0.37) ALDH1A1LMNATSHRDUTCHRM5
SCHEMBL27241092 0.82 DUT (0.42) DUT
SCHEMBL9007756 0.82 DUT (0.42) DUT
SCHEMBL14245094 0.82 DUT (0.42) DUT
SCHEMBL10018323 0.81 PAOX (0.41) ALDH1A1TSHRDUT
SCHEMBL19261678 0.81 USP2 (0.37) ALDH1A1LMNADUTSMN1; SMN2PRKCA
SCHEMBL19460464 0.81 DUT (0.39) ALDH1A1DUT
SCHEMBL23121237 0.81 EPHX1 (0.56) LMNADUTCHRM5CHRM1CHRM3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160296494-A1 DIHYDROOROTIC AND ACID DEHYDROGENASE INHIBITOR NAI INC. 2016-10-13 US disclosed
US-20130296422-A1 Novel Dihydroxybenzene Derivatives and Antiprotozoal Agent Comprising Same as Active Ingredient ARIGEN PHARMACEUTICALS, INC. (JP) 2013-11-07 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-20130296422-A1 Novel Dihydroxybenzene Derivatives and Antiprotozoal Agent Comprising Same as Active Ingredient CBR3, CBR1, DHX35 ALDH1A1 1072/4885LMNA 3363/4885APOBEC3A 4700/4885
US-20160296494-A1 DIHYDROOROTIC AND ACID DEHYDROGENASE INHIBITOR DHODH, DPYD, DLD ALDH1A1 75/4885LMNA 4867/4885APOBEC3A 3776/4885

“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.