SCHEMBL25199792

SCHEMBL25199792

COP(Cl)Oc1ccccc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA14 Q9ULX7 1/20 0.37
ACHE P22303 1/20 0.36
ALDH1A1 P00352 3/20 0.35
GLA P06280 1/20 0.35
CYP1A2 P05177 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ALOX5 P09917 1/20 0.34
PTGS1 P23219 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
SCHEMBL3128896 0.89 TSHR (0.43) TSHRSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL11120754 0.80 TSHR (0.43) TSHRSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL25226070 0.79 TSHR (0.36) TSHRSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL25199054 0.79 TDP1 (0.36) TSHRSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL28282430 0.78 TSHR (0.42) TSHRSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL15759300 0.78 TSHR (0.42) TSHRSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL13479766 0.77 SMN1; SMN2 (0.41) TSHRSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL27594718 0.77 SMN1; SMN2 (0.41) TSHRSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL11814339 0.77 TSHR (0.41) TSHRSMN1; SMN2MEN1KMT2ANPC1
SCHEMBL8651327 0.76 TSHR (0.43) TSHRSMN1; SMN2MEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US claimed
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US disclosed