SCHEMBL14833539

SCHEMBL14833539

Cn1c(CN(CC2CC2)C(=O)O)nc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.50
USP2 O75604 1/20 0.50
ALDH1A1 P00352 2/20 0.48
LMNA P02545 3/20 0.48
MAPT P10636 2/20 0.48
KMT2A Q03164 1/20 0.48
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
KDM4E B2RXH2 2/20 0.47
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
GRM2 Q14416 1/20 0.46
TSHR P16473 2/20 0.44
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
RECQL P46063 1/20 0.44
GAA P10253 1/20 0.43

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
SCHEMBL14847952 0.84 MAPT (0.48) HDAC6SMN1; SMN2USP2ALDH1A1LMNA
SCHEMBL2909929 0.82 HDAC6 (0.54) HDAC6SMN1; SMN2USP2ALDH1A1LMNA
SCHEMBL14685201 0.74 DDB1 (0.58) HDAC6SMN1; SMN2LMNAMAPTKMT2A
SCHEMBL10540150 0.74 HTR2B (0.53) HDAC6USP2ALDH1A1DDB1CRBN
SCHEMBL10540138 0.74 HTR2B (0.53) HDAC6USP2ALDH1A1DDB1CRBN
SCHEMBL31248989 0.72 SMN1; SMN2 (0.65) HDAC6SMN1; SMN2USP2ALDH1A1LMNA
SCHEMBL3746825 0.72 SMN1; SMN2 (0.65) HDAC6SMN1; SMN2USP2ALDH1A1LMNA
SCHEMBL3372477 0.72 HDAC1 (0.58) HDAC6ALDH1A1LMNAKMT2AKDM4E
SCHEMBL17933571 0.71 HDAC6 (0.72) HDAC6SMN1; SMN2USP2ALDH1A1LMNA
SCHEMBL5610013 0.71 SMN1; SMN2 (0.68) HDAC6SMN1; SMN2USP2ALDH1A1LMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2760845-B1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER AMGEN INC (US) 2016-11-16 EP disclosed
US-9376425-B2 Heterocyclic compounds as MDM2 inhibitors for the treatment of cancer AMGEN, INC. (US) 2016-06-28 US disclosed
US-20140235629-A1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER AMGEN INC. 2014-08-21 US disclosed
EP-2760845-A1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER Amgen Inc. (US) 2014-08-06 EP disclosed
WO-2013049250-A1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2013-04-04 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-20140235629-A1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER MDM2, TP53, CDKN1A HDAC6 130/4885SMN1; SMN2 2972/4885USP2 835/4885

“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.