SCHEMBL7031076

SCHEMBL7031076

CCCCN(CCCC)c1cccc2c(S(=O)(=O)N3CCN(CCc4ccc(F)cc4)CC3)cccc12

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.43
ATM Q13315 1/20 0.43
PKM P14618 1/20 0.39
HTR2A P28223 2/20 0.39
HTR1A P08908 1/20 0.39
DRD2 P14416 1/20 0.39
HTR7 P34969 1/20 0.39
HTR6 P50406 1/20 0.39
MEN1 O00255 4/20 0.39
OPRM1 P35372 1/20 0.38
TMEM97 Q5BJF2 1/20 0.38
KCNH2 Q12809 2/20 0.38
HTR2C P28335 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KCNJ1 P48048 1/20 0.37
TGM2 P21980 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL7031186 0.86 KMT2A (0.60) KMT2AATMPKMHTR2AHTR1A
SCHEMBL7028323 0.80 POLB (0.50) KMT2APKMHTR2AHTR1ADRD2
SCHEMBL7029577 0.78 GPR183 (0.54) KMT2APKMHTR2AHTR1ADRD2
SCHEMBL7030762 0.75 KMT2A (0.52) KMT2APKMHTR2AHTR1ADRD2
SCHEMBL7027414 0.72 MEN1 (0.48) KMT2APKMHTR2AMEN1KCNH2
SCHEMBL7027996 0.72 MEN1 (0.49) KMT2APKMHTR2AMEN1KCNH2
SCHEMBL7029110 0.71 PRKD3 (0.57) KMT2AHTR2AHTR1ADRD2HTR7
SCHEMBL7027668 0.71 FABP1 (0.65) PKMHTR2AHTR2CALDH1A1MAPT
SCHEMBL7023347 0.70 SMN1; SMN2 (0.68) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL7027267 0.70 KMT2A (0.68) KMT2APKMMEN1ALDH1A1MAPT

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-20030130287-A1 Piperidine and piperazine derivatives which function as 5-ht2a receptor antagonists MERCK PATENT GMBH (DE) 2003-07-10 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-20030130287-A1 Piperidine and piperazine derivatives which function as 5-ht2a receptor antagonists HTR2A, HTR1A, HTR5A KMT2A 472/4885ATM 2124/4885PKM 1353/4885

“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.