SCHEMBL29549327

SCHEMBL29549327

Cc1cccc([N+](=O)[O-])c1Nc1nc(Cl)ncc1Cl

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 8/20 0.51
LCK P06239 2/20 0.46
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
TSHR P16473 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KCNMA1 Q12791 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL22807430 1.00 PIN1 (0.51) PIN1LCKMAPTKMT2ATSHR
SCHEMBL22807432 0.85 PIN1 (0.51) PIN1LCKMAPTKMT2ASMN1; SMN2
SCHEMBL29549204 0.85 PIN1 (0.51) PIN1LCKMAPTKMT2ASMN1; SMN2
SCHEMBL21846996 0.79 PIN1 (0.59) PIN1MAPTKMT2ASMN1; SMN2MEN1
SCHEMBL30939734 0.79 PIN1 (0.59) PIN1MAPTKMT2ASMN1; SMN2MEN1
SCHEMBL31684796 0.78 LCK (0.46) LCKMAPTKMT2AALDH1A1
SCHEMBL6193458 0.77 PIN1 (0.54) PIN1LCKMAPTKMT2ASMN1; SMN2
SCHEMBL22807418 0.76 BRD4 (0.71)
SCHEMBL1080985 0.75 JAK3 (0.47) LCKSMN1; SMN2ALDH1A1
SCHEMBL27154560 0.75 KMT2A (0.46) LCKMAPTKMT2ATSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4617261-A1 2,4,5-TRISUBSTITUTED PYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Wenzhou Medical University (CN) 2025-09-17 EP disclosed
CN-115894381-B 2,4, 5-Trisubstituted pyrimidine compound and preparation method and application thereof 温州医科大学 2024-10-18 CN disclosed
EP-3986411-A1 SMALL MOLECULE INHIBITORS OF SRC TYROSINE KINASE Dana-Farber Cancer Institute, Inc. (US) 2022-04-27 EP disclosed