SCHEMBL9724043

SCHEMBL9724043

CCOC(=O)C1CSCN1C(=O)Cc1ccc(Cl)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
MAPK1 P28482 1/20 0.42
RECQL P46063 1/20 0.42
KMT2A Q03164 4/20 0.42
P2RX7 Q99572 2/20 0.40
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ERCC1 P07992 1/20 0.39
ERCC4 Q92889 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
DPP4 P27487 1/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL9724032 0.85 KMT2A (0.38) TSHRMAPK1RECQLKMT2ASMN1; SMN2
SCHEMBL9386772 0.83 KMT2A (0.40) TSHRKMT2AP2RX7LMNASMN1; SMN2
SCHEMBL9724044 0.82 P2RX7 (0.36) TSHRKMT2AP2RX7LMNASMN1; SMN2
SCHEMBL9724034 0.81 KMT2A (0.50) TSHRKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL8877689 0.80 TSHR (0.42) TSHRMAPK1RECQLKMT2AP2RX7
SCHEMBL9727236 0.80 TSHR (0.57) TSHRMAPK1RECQLKMT2AP2RX7
SCHEMBL8877593 0.80 TSHR (0.42) TSHRMAPK1RECQLKMT2AP2RX7
SCHEMBL8876826 0.80 TSHR (0.46) TSHRMAPK1RECQLKMT2AP2RX7
SCHEMBL8875871 0.80 TSHR (0.41) TSHRMAPK1RECQLKMT2AP2RX7
SCHEMBL8875647 0.79 TSHR (0.45) TSHRMAPK1RECQLKMT2AP2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5116836-A Herbicides, insecticides, miticides BAYER AKTIENGESELLSCHAFT (DE) 1992-05-26 US disclosed