SCHEMBL6802404

SCHEMBL6802404

O=C(N1CCc2ccc(S(=O)(=O)NCCN3CCN(Cc4ccccc4)CC3)cc2CC1)C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
ALDH1A1 P00352 7/20 0.55
TSHR P16473 1/20 0.55
LMNA P02545 5/20 0.53
MAPK1 P28482 1/20 0.52
HTR7 P34969 4/20 0.52
KMT2A Q03164 5/20 0.46
SLC2A1 P11166 2/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.44
BCL2 P10415 1/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43

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
SCHEMBL7848854 0.85 HDAC3 (0.57) SMN1; SMN2ALDH1A1LMNAMAPK1KMT2A
SCHEMBL6802856 0.81 HTR7 (0.58) SMN1; SMN2ALDH1A1TSHRLMNAMAPK1
Hydrochloric Acid SCHEMBL6798090 0.81 HTR7 (0.57) SMN1; SMN2ALDH1A1TSHRLMNAMAPK1
SCHEMBL7848948 0.80 CCR3 (0.54) SMN1; SMN2ALDH1A1LMNAKMT2AMEN1
SCHEMBL7848872 0.79 KMT2A (0.49) SMN1; SMN2ALDH1A1LMNAKMT2AMEN1
SCHEMBL5577978 0.77 ALDH1A1 (0.58) ALDH1A1TSHRLMNAKMT2AMEN1
SCHEMBL10035534 0.76 HTR7 (0.63) SMN1; SMN2ALDH1A1LMNAMAPK1HTR7
SCHEMBL7849483 0.76 HDAC3 (0.56) SMN1; SMN2LMNAKMT2ASLC2A1MEN1
Hydrochloric Acid SCHEMBL2138390 0.75 HTR7 (0.62) SMN1; SMN2ALDH1A1LMNAMAPK1HTR7
SCHEMBL8980468 0.75 HTR7 (0.64) SMN1; SMN2ALDH1A1LMNAMAPK1HTR7

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-20040063699-A1 Gpr14 antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-01 US disclosed
EP-1310490-A1 GPR14 ANTAGONIST Takeda Chemical Industries, Ltd. (JP) 2003-05-14 EP 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-20040063699-A1 Gpr14 antagonist GPR142, GPR139, GPR4 SMN1; SMN2 4348/4885ALDH1A1 2561/4885TSHR 1026/4885

“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.