SCHEMBL23918902

SCHEMBL23918902

CCCCCCC(CCCCC)c1c(I)cc(I)cc1I

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.35
TTR P02766 1/20 0.33
LMNA P02545 1/20 0.33
ESR1 P03372 1/20 0.33
DNM1 Q05193 2/20 0.32
OPRM1 P35372 1/20 0.31
TSHR P16473 1/20 0.31
THRB P10828 1/20 0.31
FDPS P14324 3/20 0.31
GPR84 Q9NQS5 2/20 0.31

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
SCHEMBL23918942 0.77 NR1I2 (0.36) NR1I2LMNAESR1
SCHEMBL23918943 0.73 NR1I2 (0.35) NR1I2LMNAESR1DNM1OPRM1
SCHEMBL23918554 0.70 NR1I2 (0.43) NR1I2LMNAESR1
SCHEMBL23918692 0.68 NR1I2 (0.35) NR1I2GPR84
SCHEMBL23918689 0.67 NR1I2 (0.36) NR1I2LMNADNM1
SCHEMBL8812385 0.67 ESR1 (0.44) ESR1TSHRTHRBGPR84
SCHEMBL21423075 0.65 MEN1 (0.41) NR1I2
SCHEMBL21286983 0.64 HTT (0.43) TTRESR1THRB
SCHEMBL26882687 0.63 PTGS2 (0.57) LMNAESR1GPR84
SCHEMBL26882878 0.63 PTGS2 (0.57) LMNAESR1GPR84

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-20210315872-A1 COMPOUNDS AND METHODS FOR EP300 or CBP MODULATION AND INDICATIONS THEREFOR Opna Bio SA (CH) 2021-10-14 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-20210315872-A1 COMPOUNDS AND METHODS FOR EP300 or CBP MODULATION AND INDICATIONS THEREFOR EP300, CREBBP, HDAC11 NR1I2 602/4885TTR 2683/4885LMNA 641/4885

“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.