SCHEMBL21473948

SCHEMBL21473948

Cn1cc(-c2cnc(N)c(C(=O)N[C@@H]3CCN(C(=O)c4ccc(/C=C/c5ccncc5)cc4)C3)c2)cn1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IKBKE Q14164 1/20 0.54
TBK1 Q9UHD2 1/20 0.54
BMPR1B O00238 3/20 0.53
BMPR1A P36894 3/20 0.53
ACVRL1 P37023 3/20 0.53
ACVR1 Q04771 3/20 0.53
TGFBR1 P36897 2/20 0.53
MERTK Q12866 14/20 0.50
AXL P30530 13/20 0.50
CCNC P24863 1/20 0.46
CDK8 P49336 1/20 0.46
RIPK1 Q13546 1/20 0.45
MET P08581 1/20 0.45
TYRO3 Q06418 1/20 0.45

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
SCHEMBL21473934 0.91 BMPR1B (0.53) IKBKETBK1BMPR1BBMPR1AACVRL1
SCHEMBL31669340 0.89 BMPR1B (0.51) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL20067752 0.88 BMPR1B (0.58) IKBKETBK1BMPR1BBMPR1AACVRL1
SCHEMBL20067672 0.87 BMPR1B (0.57) IKBKETBK1BMPR1BBMPR1AACVRL1
SCHEMBL20067643 0.87 BMPR1B (0.57) IKBKETBK1BMPR1BBMPR1AACVRL1
SCHEMBL21460284 0.86 BMPR1B (0.61) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL20067644 0.86 BMPR1B (0.61) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL21473933 0.86 BMPR1B (0.48) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL21460357 0.86 BMPR1B (0.54) IKBKETBK1BMPR1BBMPR1AACVRL1
SCHEMBL21460287 0.84 BMPR1B (0.56) BMPR1BBMPR1AACVRL1ACVR1TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3523292-B1 HETEROARYL COMPOUNDS AND THEIR USE AS MER INHIBITORS DONG A SOCIO HOLDINGS CO LTD (KR) 2021-12-15 EP disclosed
US-20210371398-A1 HETEROARYL COMPOUNDS AND THEIR USE AS MER INHIBITORS DONG A SOCIO HOLDINGS CO LTD (KR) 2021-12-02 US disclosed
US-10913730-B2 Heteroaryl compounds and their use as Mer inhibitors DONG-A SOCIO HOLDINGS CO., LTD. (KR) 2021-02-09 US disclosed
US-20190315716-A1 HETEROARYL COMPOUNDS AND THEIR USE AS MER INHIBITORS DONG-A ST CO., LTD. (KR) 2019-10-17 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 (3 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-10913730-B2 Heteroaryl compounds and their use as Mer inhibitors MERTK, RET, ERBB4 IKBKE 908/4885TBK1 1320/4885BMPR1B 1108/4885
US-20190315716-A1 HETEROARYL COMPOUNDS AND THEIR USE AS MER INHIBITORS MERTK, RET, ERBB4 IKBKE 908/4885TBK1 1320/4885BMPR1B 1108/4885
US-20210371398-A1 HETEROARYL COMPOUNDS AND THEIR USE AS MER INHIBITORS MERTK, RET, ERBB2 IKBKE 971/4885TBK1 1422/4885BMPR1B 817/4885

“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.