SCHEMBL20120101

SCHEMBL20120101

OC(O)c1ccc(CNc2nc(Cl)nc3[nH]cc(F)c23)cc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 0.40
PDE5A O76074 1/20 0.36
APP P05067 1/20 0.36
PDE2A O00408 2/20 0.36
CHUK O15111 1/20 0.35
CCNE2 O96020 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
ABL1 P00519 1/20 0.33
SRC P12931 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
TMIGD3 P0DMS9 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33

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
SCHEMBL20119362 0.82 PDE5A (0.40) ESR1PDE5AAPPPDE2ACHUK
SCHEMBL20119714 0.82 VNN1 (0.42) ESR1PDE5AAPPCNR1
SCHEMBL20119651 0.78 APP (0.44) ESR1PDE5AAPPPDE2ACNR1
SCHEMBL20119666 0.72 SMN1; SMN2 (0.57)
SCHEMBL20119892 0.71 KCNH3 (0.43) PDE2ACCNE1CDK2SRC
SCHEMBL20119883 0.70 PDE5A (0.40) ESR1PDE5AAPPCHUKTMIGD3
SCHEMBL20344048 0.69 PDE5A (0.52) ESR1PDE5AAPPCHUKCDK2
SCHEMBL20119563 0.69 HRH4 (0.36) ESR1
SCHEMBL20119884 0.68 ESR1 (0.44) ESR1PDE5AAPPCHUK
SCHEMBL1018453 0.67 CHUK (0.39) CHUK

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-10676475-B2 Compounds for improving mRNA splicing THE GENERAL HOSPITAL CORPORATION (US) 2020-06-09 US disclosed
US-20180118748-A1 Compounds for Improving mRNA Splicing THE GENERAL HOSPITAL CORPORATION 2018-05-03 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-10676475-B2 Compounds for improving mRNA splicing RTCB, RBM17, HNRNPA2B1 ESR1 4474/4885PDE5A 3202/4885APP 604/4885
US-20180118748-A1 Compounds for Improving mRNA Splicing RTCB, RBM17, HNRNPA2B1 ESR1 4474/4885PDE5A 3202/4885APP 604/4885

“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.