SCHEMBL11216037

SCHEMBL11216037

[NH]C(=O)CSc1ccc(F)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.41
TSHR P16473 2/20 0.40
SLC2A1 P11166 1/20 0.38
KDM4E B2RXH2 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
RAB9A P51151 4/20 0.36
KMT2A Q03164 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 2/20 0.36
PIK3CA P42336 1/20 0.36
NPC1 O15118 3/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL11218202 0.87 TDP1 (0.37) FABP4KDM4ETDP1RAB9AKMT2A
SCHEMBL11524991 0.85 FABP4 (0.52) FABP4TSHRKDM4ERAB9AALDH1A1
SCHEMBL11218670 0.84 DAO (0.43) TSHRTDP1RAB9AKMT2ASMN1; SMN2
SCHEMBL4262487 0.83 PKM (0.47) FABP4TSHRSLC2A1KDM4ERAB9A
SCHEMBL11216050 0.83 SMN1; SMN2 (0.50) FABP4TSHRSLC2A1KDM4EKMT2A
SCHEMBL11211574 0.80 ALDH1A1 (0.41) KMT2AALDH1A1MEN1NPC1LMNA
SCHEMBL11218295 0.78 KMT2A (0.54) TSHRRAB9AKMT2ASMN1; SMN2ALDH1A1
SCHEMBL30888553 0.75 FABP4 (0.43) FABP4TSHRTDP1RAB9AKMT2A
SCHEMBL11212864 0.74 ALDH1A1 (0.50) TDP1RAB9AKMT2ASMN1; SMN2ALDH1A1
SCHEMBL2652648 0.73 TSHR (0.41) TSHRKDM4ERAB9AKMT2ASMN1; SMN2

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-4329454-A Cephalosporin compounds ELI LILLY AND COMPANY (US) 1982-05-11 US disclosed
US-4144391-A REPLACING AN ACETOXY GROUP BY A SULFUR NUCLEOPHILE ELI LILLY AND COMPANY (US) 1979-03-13 US disclosed