SCHEMBL5629271

SCHEMBL5629271

CC(=O)Nc1ccccc1C(O)CNCCc1ccc(Cl)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.55
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
HPGD P15428 1/20 0.44
CNR1 P21554 1/20 0.43
ADRB3 P13945 3/20 0.42
ADRB1 P08588 2/20 0.42
METAP2 P50579 4/20 0.42
TAAR1 Q96RJ0 1/20 0.42
PLAAT3 P53816 1/20 0.41
PLAAT5 Q96KN8 1/20 0.41
PLAAT2 Q9NWW9 1/20 0.41
PLAAT4 Q9UL19 1/20 0.41
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
OPRK1 P41145 1/20 0.40
METAP1 P53582 3/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL980298 0.89 LMNA (0.46) LMNAMEN1KMT2AADRB3ADRB1
SCHEMBL981084 0.89 OPRK1 (0.52) LMNAMEN1KMT2AATML3MBTL1
SCHEMBL6767703 0.80 CNR1 (0.53) LMNAMEN1KMT2ACNR1ADRB3
SCHEMBL5631220 0.79 MEN1 (0.52) MEN1KMT2AHPGDCNR1ADRB3
SCHEMBL4034490 0.78 LMNA (0.45) LMNATDP1GAA
SCHEMBL5628156 0.78 LMNA (0.57) LMNAMEN1KMT2AHPGDCNR1
SCHEMBL6767270 0.76 KMT2A (0.59) LMNAMEN1KMT2AHPGDADRB3
SCHEMBL979107 0.75 SLC6A2 (0.51) LMNAGAA
SCHEMBL10875906 0.71 OPRK1 (0.45) LMNAMEN1KMT2AHPGDCNR1
SCHEMBL980297 0.70 PYCR1 (0.43) LMNAMEN1KMT2AL3MBTL1

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-7241775-B2 Composition, process of making, and medical use of substituted 4-phenyltetrahydroisoquinolines SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-07-10 US disclosed
US-20050009863-A1 Composition, process of making, and medical use of substituted 4-phenyltetrahydroisoquinolines AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-01-13 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-20050009863-A1 Composition, process of making, and medical use of substituted 4-phenyltetrahydroisoquinolines CYP27A1, CYP11B2, CYP7A1 LMNA 906/4885MEN1 3067/4885KMT2A 2273/4885

“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.