SCHEMBL8400560

SCHEMBL8400560

CSc1cc(C(=O)O)c(SC)c2c1OCCC2OCCF

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL8307791 0.88 TSHR (0.34) TSHRMEN1KMT2A
SCHEMBL8307812 0.81 TAAR1 (0.40) TSHRKMT2A
SCHEMBL6721501 0.77 MEN1 (0.34) TSHRMEN1KMT2A
SCHEMBL6723904 0.68 KDM4E (0.32)
SCHEMBL8134513 0.68 KDM4E (0.33) TSHR
SCHEMBL7980027 0.65 TSHR (0.35) TSHR
SCHEMBL8122612 0.65 MEN1 (0.33) MEN1KMT2A
SCHEMBL8071874 0.63 TSHR (0.32) TSHR
SCHEMBL7994484 0.63 TSHR (0.39) TSHR
SCHEMBL8304938 0.63 TSHR (0.41) TSHRMEN1KMT2A

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-5863866-A HERBICIDES TO KILL WEEDS BUT NOT CROPS IDEMITSU KOSAN CO., LTD. (JP) 1999-01-26 US disclosed
EP-0819691-A1 PYRAZOLE DERIVATIVES IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-01-21 EP disclosed