SCHEMBL6937970

SCHEMBL6937970

O=C(Oc1c(F)c(F)c(F)c(F)c1F)C1CCCC(F)C1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CHRM2 P08172 1/20 0.34
▸ CHRM4 P08173 1/20 0.34
▸ CHRM1 P11229 1/20 0.34
▸ CHRM3 P20309 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ HPGD P15428 1/20 0.31
▸ ATM Q13315 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
SCHEMBL20767013 0.86 KMT2A (0.53) HTTKMT2ASMN1; SMN2TDP1TSHR
SCHEMBL18556770 0.82 HTT (0.40) HTTKMT2ASMN1; SMN2TDP1TSHR
SCHEMBL27302811 0.80 TSHR (0.47) HTTKMT2ASMN1; SMN2TDP1TSHR
SCHEMBL20766727 0.78 KMT2A (0.42) HTTKMT2ASMN1; SMN2TDP1TSHR
SCHEMBL18733388 0.77 SMN1; SMN2 (0.43) HTTKMT2ASMN1; SMN2TDP1CHRM2
SCHEMBL14725889 0.77 SMN1; SMN2 (0.43) HTTKMT2ASMN1; SMN2TDP1CHRM2
SCHEMBL16671330 0.76 HTT (0.32) HTTKMT2ASMN1; SMN2TDP1
SCHEMBL10087740 0.72 TAS1R3 (0.46) HTTKMT2ASMN1; SMN2TDP1TSHR
SCHEMBL25128746 0.72 KMT2A (0.37) HTTKMT2ASMN1; SMN2TDP1TSHR
SCHEMBL17968590 0.71 POLB (0.42) HTTKMT2ASMN1; SMN2TDP1TSHR

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-0972776-B1 A phosphine sulfide, a manufacturing process therefor and a use thereof MITSUI CHEMICALS INC (JP) 2003-04-23 — — EP disclosed
US-6153794-A Phosphine sulfide, a manufacturing process therefor and use thereof MITSUI CHEMICALS, INC. (JP) 2000-11-28 — — US disclosed
CN-1262276-A Phosphine sulfide preparing process and use thereof MITSUI CHEMICALS INC (JP) 2000-08-09 — — CN disclosed
EP-0972776-A1 A phosphine sulfide, a manufacturing process therefor and a use thereof Mitsui Chemicals, Inc. (JP) 2000-01-19 — — EP disclosed
Send feedback