SCHEMBL16236981

SCHEMBL16236981

Clc1ncnc2c1c(I)cn2Cc1cccnc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ NR2F2 P24468 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SCN9A Q15858 1/20 0.39
▸ ADRA1D P25100 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CHRNB2 P17787 1/20 0.38
▸ CHRNA4 P43681 1/20 0.38
▸ SLC29A1 Q99808 2/20 0.37
▸ HSD17B13 Q7Z5P4 1/20 0.37
▸ CHRM1 P11229 1/20 0.37
▸ ADK P55263 3/20 0.37
▸ CYP11B1 P15538 1/20 0.37
▸ GRIN2B Q13224 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ ALDH1A1 P00352 2/20 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
SCHEMBL18342054 0.87 MEN1 (0.51) MEN1NR2F2KMT2ASLC29A1ADK
SCHEMBL16235957 0.85 ADK (0.40) MEN1NR2F2KMT2ASCN9AMAPK1
SCHEMBL16236697 0.85 DYRK3 (0.48) SCN9AMAPK1HTTCHRNB2CHRNA4
SCHEMBL17406839 0.82 GRIN2B (0.43) KDM4CMEN1NR2F2KMT2ASCN9A
SCHEMBL29484482 0.76 SRC (0.50) SLC29A1ADK
SCHEMBL22084739 0.76 SRC (0.50) SLC29A1ADK
SCHEMBL3815365 0.74 SLC29A1 (0.48) MEN1KMT2ALMNASMN1; SMN2SLC29A1
SCHEMBL20162937 0.74 DRD2 (0.40) MEN1NR2F2KMT2ASCN9ALMNA
SCHEMBL30037541 0.74 DRD2 (0.40) MEN1NR2F2KMT2ASCN9ALMNA
SCHEMBL17406900 0.72 MEN1 (0.76) KDM4CMEN1NR2F2KMT2ASCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2997030-B1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2017-08-09 — — EP disclosed
US-9682083-B2 Pyrrolo[2,3-D]pyrimidine derivatives, process for their preparation and their use as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2017-06-20 — — US disclosed
US-20160166575-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2016-06-16 — — US disclosed
EP-2997030-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2016-03-23 — — EP disclosed
WO-2014184069-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2014-11-20 — — 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-20160166575-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS RET, DCK, PRKD2 KDM4C 1287/4885MEN1 3235/4885NR2F2 2307/4885

“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.

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