SCHEMBL9761206

SCHEMBL9761206

COc1cccc(C(F)(F)F)c1NS(=O)(=O)c1nn2c(C)cc(C)nc2c1Cl

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
HTR6 P50406 5/20 0.39
P2RX7 Q99572 5/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
CCR4 P51679 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
SCHEMBL9761046 0.84 ALDH1A1 (0.51) TSHRKDM4E
SCHEMBL9760156 0.81 KDM4E (0.46) TSHRKDM4EPOLB
SCHEMBL8351725 0.81 TSHR (0.64) TSHRKDM4EPOLB
SCHEMBL9761030 0.80 HTR6 (0.46) TSHRHTR6KDM4E
SCHEMBL8358959 0.74 TSHR (0.52) TSHRKDM4E
SCHEMBL9789247 0.72 TSHR (0.43) TSHRP2RX7KDM4ECCR4
SCHEMBL10658767 0.72 TSHR (0.47) TSHRPOLB
SCHEMBL10668742 0.70 TSHR (0.42) TSHRCCR4
SCHEMBL10774163 0.69 KDM4E (0.44) TSHRHTR6KDM4E
SCHEMBL8357182 0.69 TSHR (0.43) TSHRCCR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4992091-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-02-12 US claimed
US-5021591-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-06-04 US disclosed
US-4997940-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-03-05 US disclosed
US-4992091-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-02-12 US disclosed