SCHEMBL2901084

SCHEMBL2901084

COCCCNc1nc(C(C)C)ncc1C(=O)N1CCC(N)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 6/20 0.49
SYK P43405 2/20 0.43
JAK3 P52333 1/20 0.41
REN P00797 3/20 0.39
TYRO3 Q06418 2/20 0.38
GAS6 Q14393 1/20 0.38
HSP90AA1 P07900 1/20 0.36
HSP90B1 P14625 1/20 0.36
LRRK2 Q5S007 1/20 0.35
TSHR P16473 1/20 0.35
KDM4E B2RXH2 2/20 0.35
SIRT5 Q9NXA8 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
AXL P30530 1/20 0.35
HTR4 Q13639 1/20 0.35
BRD4 O60885 1/20 0.34

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
SCHEMBL2897413 0.89 MERTK (0.61) MERTKSYKTYRO3GAS6AXL
SCHEMBL2898749 0.86 MERTK (0.47) MERTKSYKJAK3RENHSP90AA1
SCHEMBL2902684 0.84 MERTK (0.49) MERTKSYKJAK3RENTYRO3
SCHEMBL2894358 0.79 JAK3 (0.44) MERTKSYKJAK3RENTYRO3
SCHEMBL2899621 0.77 MERTK (0.44) MERTKLRRK2TSHRKDM4EALDH1A1
SCHEMBL2902620 0.73 MERTK (0.60) MERTKSYKRENTYRO3GAS6
SCHEMBL2900049 0.70 MERTK (0.47) MERTKJAK3RENKDM4EALDH1A1
SCHEMBL2897231 0.69 HRH4 (0.40) JAK3RENTYRO3LRRK2
SCHEMBL2903504 0.68 REN (0.53) MERTKRENTYRO3GAS6ALDH1A1
SCHEMBL2901196 0.66 KDM6B (0.46) MERTKJAK3TYRO3GAS6SIRT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2202228-B1 AMIDE COMPOUNDS AND USE OF THE SAME TAKEDA PHARMACEUTICAL (JP) 2014-12-10 EP disclosed
US-8329691-B2 Amide compounds and use of the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-11 US disclosed
US-8329691-B2 Amide compounds and use of the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-11 US disclosed
US-8329691-B2 Amide compounds and use of the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-11 US disclosed
US-20100324010-A1 AMIDE COMPOUNDS AND USE OF THE SAME TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-23 US disclosed
US-20100324010-A1 AMIDE COMPOUNDS AND USE OF THE SAME TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-23 US disclosed
US-20100324010-A1 AMIDE COMPOUNDS AND USE OF THE SAME TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-23 US disclosed
EP-2202228-A1 AMIDE COMPOUNDS AND USE OF THE SAME Takeda Pharmaceutical Company Limited (JP) 2010-06-30 EP disclosed
EP-2202228-A1 AMIDE COMPOUNDS AND USE OF THE SAME Takeda Pharmaceutical Company Limited (JP) 2010-06-30 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-20100324010-A1 AMIDE COMPOUNDS AND USE OF THE SAME REN, ACE, AGT MERTK 3317/4885SYK 2977/4885JAK3 4011/4885

“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.