SCHEMBL23913085

SCHEMBL23913085

Cn1nc(C(F)(F)F)cc1-c1ccc(OCc2ccc(Cl)cc2)c(-c2cccc(C#N)c2)c1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.40
PTGER1 P34995 1/20 0.39
SCN9A Q15858 2/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.37
CCR5 P51681 1/20 0.35
SLC6A4 P31645 1/20 0.35
RORC P51449 1/20 0.35
ALOX5 P09917 1/20 0.35
ALOX5AP P20292 1/20 0.35
ARF6 P62330 1/20 0.35
LRRK2 Q5S007 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
CNR1 P21554 2/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CNR2 P34972 1/20 0.35
KCNH2 Q12809 1/20 0.35
SLC16A3 O15427 1/20 0.34
SLC16A1 P53985 1/20 0.34

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
SCHEMBL21786621 0.91 ARF6 (0.40) SCN9ACCR5ARF6CNR1
SCHEMBL21786498 0.90 SCN9A (0.37) SCN9ACCR5CNR1PRKDC
SCHEMBL21786530 0.88 MAPT (0.40) MRGPRX4SLC6A4LRRK2
SCHEMBL21786411 0.88 KCNT1 (0.36) MRGPRX4PTGER1SCN9ARAB9A
SCHEMBL21786412 0.86 MRGPRX4 (0.40) MRGPRX4PTGER1PTGDR2CCR5SLC6A4
SCHEMBL21786460 0.85 PTGER1 (0.42) MRGPRX4PTGER1CYP2C9
SCHEMBL21786633 0.85 SCN9A (0.37) MRGPRX4PTGER1SCN9AARF6PRKDC
SCHEMBL21786450 0.84 CYP11B1 (0.39) PTGER1LRRK2RAB9ACYP2C9
SCHEMBL21786589 0.84 STIM1 (0.37) MRGPRX4SCN9ASLC6A4CNR1CYP2C9
SCHEMBL21786416 0.84 SLC6A4 (0.41) MRGPRX4PTGER1PTGDR2SLC6A4ARF6

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-11142504-B2 Substituted heterocycles as c-MYC targeting agents NORTHWESTERN UNIVERSITY (US) 2021-10-12 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-11142504-B2 Substituted heterocycles as c-MYC targeting agents MYC, MYCBP, MYCBP2 MRGPRX4 3150/4885PTGER1 4862/4885SCN9A 4686/4885

“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.