SCHEMBL9574273

SCHEMBL9574273

COSC(SOC)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
DPP4 P27487 2/20 0.36
TSHR P16473 2/20 0.36
F2 P00734 1/20 0.36
CA4 P22748 1/20 0.36
TAAR1 Q96RJ0 2/20 0.34
HTR2A P28223 1/20 0.34
HRH1 P35367 1/20 0.34
LMNA P02545 1/20 0.34
EPHX1 P07099 1/20 0.34
THRB P10828 1/20 0.34
ALDH1A1 P00352 1/20 0.34
ACP3 P15309 1/20 0.34
IDO1 P14902 1/20 0.34
TDO2 P48775 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
SCHEMBL9712055 0.76 CHRM2 (0.42) KMT2ATSHRHTR2ALMNAALDH1A1
SCHEMBL2320123 0.70 DPP4 (0.41) DPP4TSHRF2TAAR1HTR2A
Isopropylbenzene SCHEMBL9742319 0.70 KMT2A (0.44) KMT2ADPP4TSHRF2CA4
Diphenylmethanol SCHEMBL11867320 0.69 SMN1; SMN2 (0.52) KMT2ALMNAALDH1A1
SCHEMBL546542 0.67 KMT2A (0.38) KMT2ADPP4TSHRF2CA4
Phenyl Ethanol SCHEMBL11249656 0.67 LMNA (0.50) KMT2ATSHRHTR2ALMNAALDH1A1
SCHEMBL26689 0.65 KMT2A (0.44) KMT2ADPP4TSHRF2CA4
SCHEMBL3842608 0.65 THRB (0.57) KMT2ADPP4TSHRF2CA4
SCHEMBL5396533 0.65 THRB (0.57) KMT2ADPP4TSHRF2CA4
SCHEMBL5474344 0.65 THRB (0.57) KMT2ADPP4TSHRF2CA4

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-0310944-B1 BISOXETHYLSULFONYLMETHYL ANILINES AND PROCESS FOR THEIR PREPARATION HOECHST AKTIENGESELLSCHAFT (DE) 1993-01-13 EP claimed
EP-0310944-A2 Bisoxethylsulfonylmethyl anilines and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1989-04-12 EP claimed
EP-0310944-B1 BISOXETHYLSULFONYLMETHYL ANILINES AND PROCESS FOR THEIR PREPARATION HOECHST AKTIENGESELLSCHAFT (DE) 1993-01-13 EP disclosed
EP-0310944-A2 Bisoxethylsulfonylmethyl anilines and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1989-04-12 EP disclosed