SCHEMBL20119645

SCHEMBL20119645

FC(F)(F)c1ccccc1CCNc1ncnc2[nH]cnc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.46
CYP3A4 P08684 4/20 0.46
CYP2D6 P10635 4/20 0.46
CYP2C19 P33261 4/20 0.46
CYP2C9 P11712 3/20 0.46
RECQL P46063 1/20 0.46
HTT P42858 5/20 0.45
LMNA P02545 5/20 0.45
MAPK1 P28482 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
TAAR1 Q96RJ0 1/20 0.43
RPS6KB1 P23443 2/20 0.43
AURKA O14965 1/20 0.43
AURKB Q96GD4 1/20 0.43
EGFR P00533 1/20 0.42
CDC7 O00311 1/20 0.42
DBF4 Q9UBU7 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
MAPT P10636 1/20 0.41
GFER P55789 1/20 0.41

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
SCHEMBL4922080 0.88 EGFR (0.55) CYP1A2CYP3A4CYP2D6CYP2C19CYP2C9
SCHEMBL20119349 0.84 HTT (0.47) HTTLMNAMAPK1SMN1; SMN2TAAR1
SCHEMBL20119877 0.81 HTT (0.47) CYP1A2CYP3A4CYP2D6CYP2C19CYP2C9
SCHEMBL4920613 0.80 AURKA (0.47) CYP1A2CYP3A4CYP2D6CYP2C19HTT
SCHEMBL9609111 0.79 EGFR (0.46) CYP1A2CYP3A4CYP2D6CYP2C19CYP2C9
SCHEMBL20119682 0.78 EGFR (0.52) CYP1A2CYP3A4CYP2D6CYP2C19RPS6KB1
SCHEMBL17933799 0.78 TSHR (0.56) CYP1A2CYP3A4CYP2D6CYP2C19CYP2C9
SCHEMBL9609211 0.78 MAPK1 (0.64) CYP1A2CYP2D6HTTLMNAMAPK1
SCHEMBL20119885 0.78 HTT (0.46) HTTLMNAMAPK1SMN1; SMN2TAAR1
SCHEMBL4916501 0.77 CD38 (0.46) CYP3A4RPS6KB1AURKAAURKBPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230279007-A1 Compounds for Improving mRNA Splicing THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2023-09-07 US disclosed
US-20230279007-A1 Compounds for Improving mRNA Splicing THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2023-09-07 US disclosed
US-11702417-B2 Compounds for improving mRNA splicing THE GENERAL HOSPITAL CORPORATION (US) 2023-07-18 US disclosed
US-11702417-B2 Compounds for improving mRNA splicing THE GENERAL HOSPITAL CORPORATION (US) 2023-07-18 US disclosed
US-20200283441-A1 Compounds for Improving mRNA Splicing THE GENERAL HOSPITAL CORPORATION 2020-09-10 US disclosed
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 (5 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-20230279007-A1 Compounds for Improving mRNA Splicing RTCB, RBM17, HNRNPA2B1 CYP1A2 4035/4885CYP3A4 4281/4885CYP2D6 3804/4885
US-10676475-B2 Compounds for improving mRNA splicing RTCB, RBM17, HNRNPA2B1 CYP1A2 4035/4885CYP3A4 4281/4885CYP2D6 3804/4885
US-20180118748-A1 Compounds for Improving mRNA Splicing RTCB, RBM17, HNRNPA2B1 CYP1A2 4035/4885CYP3A4 4281/4885CYP2D6 3804/4885
US-11702417-B2 Compounds for improving mRNA splicing RTCB, RBM17, HNRNPA2B1 CYP1A2 4035/4885CYP3A4 4281/4885CYP2D6 3804/4885
US-20200283441-A1 Compounds for Improving mRNA Splicing RTCB, RBM17, HNRNPA2B1 CYP1A2 4035/4885CYP3A4 4281/4885CYP2D6 3804/4885

“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.