SCHEMBL7023347

SCHEMBL7023347

O=S(=O)(c1cccc2nsnc12)N1CCN(CCc2ccc(F)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.68
POLB P06746 1/20 0.68
KMT2A Q03164 5/20 0.65
LMNA P02545 4/20 0.60
ALDH1A1 P00352 3/20 0.60
MEN1 O00255 2/20 0.60
CYP1A2 P05177 1/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
TDP1 Q9NUW8 2/20 0.58
MAPK1 P28482 3/20 0.57
USP2 O75604 1/20 0.57
TP53 P04637 1/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 1/20 0.53

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
SCHEMBL13254370 0.89 KMT2A (0.65) SMN1; SMN2POLBKMT2ALMNAALDH1A1
SCHEMBL7027267 0.83 KMT2A (0.68) POLBKMT2ALMNAALDH1A1MEN1
SCHEMBL7027668 0.80 FABP1 (0.65) ALDH1A1MAPK1GAAMAPT
SCHEMBL7029577 0.77 GPR183 (0.54) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL7027996 0.76 MEN1 (0.49) KMT2AALDH1A1MEN1GAA
SCHEMBL7028323 0.76 POLB (0.50) SMN1; SMN2POLBKMT2ALMNAMEN1
SCHEMBL6985771 0.74 KMT2A (0.79) SMN1; SMN2POLBKMT2ALMNAALDH1A1
SCHEMBL7029110 0.74 PRKD3 (0.57) SMN1; SMN2KMT2AMEN1CYP1A2CYP2C19
SCHEMBL7026165 0.74 KCNH2 (0.69) SMN1; SMN2KMT2AALDH1A1MEN1TDP1
SCHEMBL7022823 0.73 PKM (0.64) POLBKMT2ALMNAALDH1A1MEN1

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 3 patents. 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
EP-1246803-A1 PIPERIDINE AND PIPERAZINE DERIVATIVES WHICH FUNCTION AS 5-HT 2A? RECEPTOR ANTAGONISTS MERCK PATENT GmbH (DE) 2002-10-09 EP disclosed
WO-2001051469-A1 PIPERIDINE AND PIPERAZINE DERIVATIVES WHICH FUNCTION AS 5-HT2A RECEPTOR ANTAGONISTS MERCK PATENT GMBH (DE) 2001-07-19 WO 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 SMN1; SMN2 430/4885POLB 1282/4885KMT2A 472/4885

“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.