SCHEMBL23009752

SCHEMBL23009752

CCCCCCCCCCCCCOc1ccc2c(c1)N(C(C)C)C(C1CCCC1)N2C(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.41
▸ HTR1B P28222 3/20 0.39
▸ THRA P10827 3/20 0.39
▸ THRB P10828 3/20 0.39
▸ HTR1D P28221 2/20 0.39
▸ NR5A1 Q13285 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ OPRM1 P35372 1/20 0.37
▸ OPRD1 P41143 1/20 0.37
▸ OPRK1 P41145 1/20 0.37
▸ SIGMAR1 Q99720 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ S1PR5 Q9H228 2/20 0.36

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
SCHEMBL17916651 0.82 NR5A1 (0.43) LTA4HHTR1BTHRATHRBHTR1D
SCHEMBL23366501 0.75 KDM4E (0.35) HTR1BHTR1DLMNASIGMAR1
SCHEMBL24613003 0.71 CYP1A2 (0.38) LMNA
SCHEMBL24613061 0.70 TSHR (0.33) TSHRLMNANPC1RAB9A
SCHEMBL26720306 0.70 SLC2A1 (0.33) HTR1BTHRATHRBNR5A1TSHR
SCHEMBL24613006 0.69 ACACB (0.34) LMNA
SCHEMBL28063059 0.65 HRH3 (0.57) LTA4HNR5A1TSHRLMNARAB9A
SCHEMBL10642885 0.64 NR5A1 (0.62) LTA4HTHRANR5A1TSHR
SCHEMBL347683 0.64 NR5A1 (0.62) LTA4HTHRANR5A1TSHR
SCHEMBL4945033 0.64 NR5A1 (0.62) LTA4HTHRANR5A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210047361-A1 OLIGONUCLEOTIDE AND NUCLEIC ACID SYNTHESIS SILICON VALLEY BANK 2021-02-18 — — 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-20210047361-A1 OLIGONUCLEOTIDE AND NUCLEIC ACID SYNTHESIS POLN, POLI, ADAR LTA4H 4009/4885HTR1B 4580/4885THRA 996/4885

“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.

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