SCHEMBL17824289

SCHEMBL17824289

COCCNC(=O)Cn1c(C)nc2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.66
HTT P42858 2/20 0.66
TSHR P16473 1/20 0.66
GSK3B P49841 10/20 0.58
KMT2A Q03164 3/20 0.53
CYP1A2 P05177 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
POLB P06746 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MEN1 O00255 2/20 0.51
THRB P10828 1/20 0.51
CYP2D6 P10635 1/20 0.51
HPGD P15428 1/20 0.51

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
SCHEMBL17824310 0.86 LMNA (0.53) LMNAHTTTSHRKMT2ARAB9A
SCHEMBL17824315 0.86 ADORA2A (0.54) LMNAHTTTSHRKMT2ACYP1A2
SCHEMBL17824318 0.82 RAB9A (0.53) LMNAHTTTSHRKMT2ARAB9A
SCHEMBL17824312 0.82 RAB9A (0.64) LMNAHTTTSHRKMT2ACYP1A2
SCHEMBL17824297 0.82 ALDH1A1 (0.67) LMNAHTTTSHRKMT2APOLB
SCHEMBL17824317 0.81 ALDH1A1 (0.59) LMNAHTTTSHRKMT2ARAB9A
SCHEMBL17824306 0.80 MAPT (0.71) TSHRCYP2C19RAB9ASMN1; SMN2
SCHEMBL12495433 0.80 ALDH1A1 (0.72) LMNAHTTTSHRGSK3BKMT2A
SCHEMBL12497263 0.80 LMNA (0.69) LMNAHTTTSHRGSK3BKMT2A
SCHEMBL3430135 0.80 LMNA (1.00) LMNAHTTTSHRGSK3BKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170362184-A1 PRO-SURVIVAL COMPOUNDS HERIOT-WATT UNIVERSITY (GB) 2017-12-21 US disclosed
US-20170362184-A1 PRO-SURVIVAL COMPOUNDS HERIOT-WATT UNIVERSITY (GB) 2017-12-21 US disclosed
US-20170362184-A1 PRO-SURVIVAL COMPOUNDS HERIOT-WATT UNIVERSITY (GB) 2017-12-21 US disclosed
EP-3230275-A1 PRO-SURVIVAL COMPOUNDS University Court of The University of Glasgow (GB) 2017-10-18 EP disclosed
WO-2016092327-A1 PRO-SURVIVAL COMPOUNDS UNIVERSITY COURT OF THE UNIVERSITY OF GLASGOW (GB) 2016-06-16 WO disclosed
WO-2016092327-A1 PRO-SURVIVAL COMPOUNDS UNIVERSITY COURT OF THE UNIVERSITY OF GLASGOW (GB) 2016-06-16 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-20170362184-A1 PRO-SURVIVAL COMPOUNDS MCL1, MKI67, MORF4L1 LMNA 301/4885HTT 3064/4885TSHR 4613/4885

“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.