SCHEMBL2162132

SCHEMBL2162132

Cc1ccc(C)c(N2CCN(C(=O)c3ccc4c(c3)c(C)c(C)n4C(Cl)c3ccccc3)CC2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.67
MAPT P10636 8/20 0.54
MEN1 O00255 7/20 0.52
KMT2A Q03164 7/20 0.52
HTT P42858 3/20 0.47
POLB P06746 1/20 0.47
LMNA P02545 2/20 0.46
USP2 O75604 1/20 0.46
MAPK10 P53779 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ALDH1A1 P00352 3/20 0.46
RECQL P46063 1/20 0.46
TSHR P16473 1/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
HPGD P15428 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL2161409 0.88 MAPT (0.65) TP53MAPTMEN1KMT2AHTT
SCHEMBL2162257 0.83 MEN1 (0.56) MAPTMEN1KMT2AHTTLMNA
SCHEMBL2162139 0.81 MEN1 (0.69) TP53MAPTMEN1KMT2AHTT
SCHEMBL2162129 0.77 TP53 (0.65) TP53MAPTMEN1KMT2AHTT
SCHEMBL16276043 0.70 MAPT (0.63) TP53MAPTMEN1KMT2AHTT
SCHEMBL2161438 0.69 MAPT (0.79) TP53MAPTMEN1KMT2AHTT
SCHEMBL2161690 0.67 MEN1 (0.71) TP53MAPTMEN1KMT2APOLB
SCHEMBL2161493 0.67 KMT2A (0.80) TP53MAPTMEN1KMT2AALDH1A1
SCHEMBL630705 0.67 KMT2A (0.70) TP53MAPTMEN1KMT2AHTT
SCHEMBL15714882 0.66 MYC (0.78) TP53MAPT

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-7985764-B2 Amide derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2011-07-26 US disclosed
US-20090062363-A1 AMIDE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-03-05 US disclosed
EP-1988076-A1 AMIDE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2008-11-05 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-20090062363-A1 AMIDE DERIVATIVE OR SALT THEREOF HTR7, HTR2B, NPSR1 TP53 4814/4885MAPT 4469/4885MEN1 3828/4885

“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.