SCHEMBL1552423

SCHEMBL1552423

Cc1cc(C[C@@H](O)CCl)ccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PNMT P11086 1/20 0.41
MEN1 O00255 2/20 0.38
HTT P42858 1/20 0.38
MCL1 Q07820 1/20 0.36
PKM P14618 1/20 0.35
S1PR1 P21453 3/20 0.35
PTPN7 P35236 1/20 0.35
DUSP3 P51452 1/20 0.35
P2RX7 Q99572 2/20 0.34
KDM4A O75164 1/20 0.33
KDM5A P29375 1/20 0.33
KDM5B Q9UGL1 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
CYP3A4 P08684 1/20 0.33
PLA2G1B P04054 1/20 0.32
TACR1 P25103 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32

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
SCHEMBL1552424 1.00 KMT2A (0.43) KMT2ASMN1; SMN2PNMTMEN1HTT
SCHEMBL1553227 0.83 PNMT (0.53) SMN1; SMN2PNMTPLA2G1B
SCHEMBL1553225 0.83 PNMT (0.53) SMN1; SMN2PNMTPLA2G1B
SCHEMBL16759183 0.83 PNMT (0.53) SMN1; SMN2PNMTPLA2G1B
SCHEMBL1551855 0.78 ALOX15 (0.45) KMT2ASMN1; SMN2MEN1HTTCYP3A4
SCHEMBL1551856 0.78 ALOX15 (0.45) KMT2ASMN1; SMN2MEN1HTTCYP3A4
SCHEMBL10019195 0.77 PNMT (0.50) KMT2ASMN1; SMN2PNMTMEN1PKM
SCHEMBL11832588 0.76 PPARG (0.49) KMT2AMEN1ESR2
SCHEMBL15800396 0.76 PNMT (0.44) KMT2ASMN1; SMN2PNMTMEN1HTT
SCHEMBL1552985 0.75 PIK3CA (0.41) KMT2APNMTMEN1HTTCYP3A4

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
EP-1844026-B1 MORPHOLINES AS 5HT2C AGONISTS HOFFMANN LA ROCHE (CH) 2011-04-27 EP disclosed
CN-101107235-B Morpholines as 5HT2C agonists HOFFMANN LA ROCHE 2011-03-16 CN disclosed
US-7323466-B2 Morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HOFFMAN-LA ROCHE INC. (US) 2008-01-29 US disclosed
CN-101107235-A Morpholines as 5HT2C agonists HOFFMANN LA ROCHE (CH) 2008-01-16 CN disclosed
EP-1844026-A2 MORPHOLINES AS 5HT2C AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2007-10-17 EP disclosed
US-20060178510-A1 New morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HOFFMANN-LA ROCHE INC. 2006-08-10 US disclosed
WO-2006077025-A2 MORPHOLINES AS 5HT2C AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-07-27 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-20060178510-A1 New morpholine derivatives as 5HT2C receptor agonists for the treatment of obesity HTR2C, HTR1A, HTR1B KMT2A 1191/4885SMN1; SMN2 2183/4885PNMT 247/4885

“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.