SCHEMBL9506687

SCHEMBL9506687

FC(F)(F)c1cccc(Cl)c1.O=C(NC(=O)c1ccccc1Cl)Nc1ccc(S)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.56
RXFP1 Q9HBX9 2/20 0.53
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
MAPT P10636 3/20 0.51
HTT P42858 3/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
RORC P51449 1/20 0.49
KDR P35968 1/20 0.48
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
GCGR P47871 1/20 0.47
PLCG2 P16885 1/20 0.47
POLB P06746 1/20 0.47
PKM P14618 1/20 0.47
ATM Q13315 1/20 0.46
PYGL P06737 2/20 0.46
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL9503789 0.91 TRPV1 (0.49) TDP1RXFP1MEN1KMT2AMAPT
SCHEMBL9506643 0.86 RXFP1 (0.49) TDP1RXFP1MEN1KMT2AMAPT
SCHEMBL9504693 0.84 IL2 (0.52) MEN1KMT2AMAPTHTTALDH1A1
Chlotrifmeuron SCHEMBL10868747 0.83 TDP1 (0.70) TDP1RXFP1MEN1KMT2AMAPT
SCHEMBL9505640 0.78 TRPV1 (0.50) RXFP1MEN1KMT2AMAPTHTT
SCHEMBL8624438 0.77 TDP1 (0.62) TDP1RXFP1ALDH1A1SMN1; SMN2RORC
SCHEMBL11254390 0.76 TDP1 (0.51) TDP1RXFP1MEN1KMT2AMAPT
SCHEMBL11253045 0.76 TDP1 (0.59) TDP1RXFP1MEN1KMT2AMAPT
Chlorbenzuron SCHEMBL5177776 0.76 GCGR (0.68) TDP1MEN1KMT2AMAPTALDH1A1
SCHEMBL8622701 0.76 TDP1 (0.55) TDP1RXFP1MEN1KMT2AMAPT

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
EP-0318882-B1 (THIO)BENZOYL UREAS, FUNCTIONAL DERIVATIVES, PROCESS FOR THEIR PREPARATION, COMPOSITIONS AND PESTICIDAL USE HOECHST AKTIENGESELLSCHAFT (DE) 1993-06-23 EP claimed
US-4954529-A MITICIDES, INSECTICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1990-09-04 US claimed
US-4966902-A INSECTICIDES, MITICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1990-10-30 US disclosed
US-4954529-A MITICIDES, INSECTICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1990-09-04 US disclosed