SCHEMBL4766002

SCHEMBL4766002

Cc1cc(OCCCn2cccc2)ccc1Nc1nc(NC2CCC(O)CC2)c2nc[nH]c2n1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TTK P33981 8/20 0.47
MERTK Q12866 2/20 0.40
AXL P30530 1/20 0.40
PRKDC P78527 3/20 0.39
CSF1R P07333 1/20 0.39
FLT3 P36888 1/20 0.38
TYRO3 Q06418 1/20 0.38
GAS6 Q14393 1/20 0.38
BTK Q06187 3/20 0.36
JAK3 P52333 1/20 0.36
ADORA3 P0DMS8 1/20 0.35
ADORA1 P30542 1/20 0.35
MAPKAPK2 P49137 1/20 0.35
PIK3CA P42336 1/20 0.35
MTOR P42345 1/20 0.35
CDK1 P06493 1/20 0.35

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
SCHEMBL3036644 0.87 BACE1 (0.43) TTKMERTKAXLPRKDCCSF1R
SCHEMBL3036637 0.87 BACE1 (0.43) TTKMERTKAXLPRKDCCSF1R
SCHEMBL2954761 0.86 TTK (0.44) TTKMERTKAXLPRKDCCSF1R
SCHEMBL2954758 0.86 TTK (0.44) TTKMERTKAXLPRKDCCSF1R
SCHEMBL2950051 0.85 TTK (0.45) TTKMERTKAXLPRKDCCSF1R
SCHEMBL2950053 0.85 TTK (0.45) TTKMERTKAXLPRKDCCSF1R
SCHEMBL2950176 0.85 TTK (0.46) TTKMERTKAXLPRKDCCSF1R
SCHEMBL4766030 0.85 TTK (0.46) TTKMERTKAXLPRKDCCSF1R
SCHEMBL3038265 0.85 TTK (0.42) TTKMERTKAXLPRKDCCSF1R
SCHEMBL3038261 0.85 TTK (0.42) TTKMERTKAXLPRKDCCSF1R

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-20120122840-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF MYREXIS, INC. (US) 2012-05-17 US disclosed
US-20120122840-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF MYREXIS, INC. (US) 2012-05-17 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-20120122840-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF VHL, TP53, ASAH2 TTK 4589/4885MERTK 1662/4885AXL 2976/4885

“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.