SCHEMBL17837241

SCHEMBL17837241

CC1(C)c2sc(-c3ccnc(Nc4ccnn4C4CC4)n3)cc2C(=O)N1CCN1CCOCC1

nearest known ligand 0.81

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 9/20 0.81
MAPK3 P27361 1/20 0.81
MAP3K14 Q99558 3/20 0.41
ABL1 P00519 2/20 0.38
BCR P11274 1/20 0.38
MKNK1 Q9BUB5 1/20 0.36
MKNK2 Q9HBH9 2/20 0.36
FLT3 P36888 1/20 0.36
ABL2 P42684 1/20 0.36
EGFR P00533 2/20 0.35
CCNB2 O95067 1/20 0.35
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
CCNB3 Q8WWL7 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
Temuterkib SCHEMBL17837273 0.90 MAPK1 (1.00) MAPK1MAPK3MAP3K14ABL1BCR
SCHEMBL17837306 0.87 MAPK1 (0.94) MAPK1MAPK3MAP3K14ABL1BCR
SCHEMBL17871041 0.86 MAPK1 (0.81) MAPK1MAPK3MAP3K14ABL1BCR
Temuterkib SCHEMBL28928408 0.85 MAPK1 (0.91) MAPK1MAPK3MAP3K14ABL1BCR
SCHEMBL21965940 0.84 MAPK1 (0.78) MAPK1MAPK3ABL1BCRMKNK1
SCHEMBL17837263 0.84 MAPK3 (0.81) MAPK1MAPK3MAP3K14ABL1BCR
SCHEMBL17837198 0.83 MAPK3 (0.77) MAPK1MAPK3MAP3K14ABL1BCR
SCHEMBL17837212 0.83 MAPK1 (0.86) MAPK1MAPK3MAP3K14
SCHEMBL17837281 0.82 MAPK3 (0.74) MAPK1MAPK3MAP3K14ABL1BCR
SCHEMBL17837242 0.82 MAPK1 (0.85) MAPK1MAPK3ABL1BCRMKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE48635-E1 ERK inhibitors ELI LILLY AND COMPANY (US) 2021-07-13 US disclosed
US-RE48635-E1 ERK inhibitors ELI LILLY AND COMPANY (US) 2021-07-13 US disclosed
EP-3237423-B1 THIENO[2,3-C]PYRROL-4-ONE DERIVATIVES AS ERK INHIBITORS LILLY CO ELI (US) 2019-06-05 EP disclosed
EP-3237423-B1 THIENO[2,3-C]PYRROL-4-ONE DERIVATIVES AS ERK INHIBITORS LILLY CO ELI (US) 2019-06-05 EP disclosed
US-20160375030-A1 ERK INHIBITORS ELI LILLY AND COMPANY 2016-12-29 US disclosed
US-20160375030-A1 ERK INHIBITORS ELI LILLY AND COMPANY 2016-12-29 US disclosed
US-9526733-B1 ERK inhibitors ELI LILLY AND COMPANY (US) 2016-12-27 US disclosed
US-9526733-B1 ERK inhibitors ELI LILLY AND COMPANY (US) 2016-12-27 US disclosed
US-9526733-B1 ERK inhibitors ELI LILLY AND COMPANY (US) 2016-12-27 US disclosed
US-9469652-B2 ERK inhibitors ELI LILLY AND COMPANY (US) 2016-10-18 US disclosed
US-9469652-B2 ERK inhibitors ELI LILLY AND COMPANY (US) 2016-10-18 US disclosed
US-9469652-B2 ERK inhibitors ELI LILLY AND COMPANY (US) 2016-10-18 US disclosed
US-20160176896-A1 ERK INHIBITORS ELI LILLY AND COMPANY 2016-06-23 US disclosed
US-20160176896-A1 ERK INHIBITORS ELI LILLY AND COMPANY 2016-06-23 US disclosed
US-20160176896-A1 ERK INHIBITORS ELI LILLY AND COMPANY 2016-06-23 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 (2 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-20160375030-A1 ERK INHIBITORS MAPK4, MAPK1, MAPK3 MAPK1 2/4885MAPK3 3/4885MAP3K14 37/4885
US-20160176896-A1 ERK INHIBITORS MAPK4, MAPK1, MAPK3 MAPK1 2/4885MAPK3 3/4885MAP3K14 37/4885

“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.