SCHEMBL11266928

SCHEMBL11266928

CCN(CC)Cc1cc(C(=O)OCCOC(C)=O)cc(Br)c1N.Clc1cccc(Cl)c1Nc1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ TP53 P04637 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ BCHE P06276 6/20 0.34
▸ HRH3 Q9Y5N1 3/20 0.33
▸ MAOA P21397 2/20 0.33
▸ HTR3A P46098 2/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ PDGFRB P09619 1/20 0.33
▸ KIT P10721 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ SRC P12931 1/20 0.33
▸ BRAF P15056 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ EPHB4 P54760 1/20 0.33
▸ TEK Q02763 1/20 0.33
▸ CHRM2 P08172 1/20 0.33

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
SCHEMBL11265476 0.97 TP53 (0.38) TSHRLMNASMN1; SMN2TP53MAPT
SCHEMBL11271896 0.97 TP53 (0.38) TSHRLMNASMN1; SMN2TP53MAPT
SCHEMBL11271775 0.96 TP53 (0.37) TSHRLMNASMN1; SMN2TP53MAPT
SCHEMBL11271322 0.96 TSHR (0.41) TSHRLMNASMN1; SMN2TP53MAPT
SCHEMBL11261658 0.96 TP53 (0.37) TSHRLMNASMN1; SMN2TP53MAPT
SCHEMBL11260654 0.91 HPGD (0.33) LMNASMN1; SMN2TP53MAPTHDAC6
SCHEMBL11268609 0.88 MAPT (0.35) LMNASMN1; SMN2TP53MAPTHDAC6
SCHEMBL11255797 0.88 KMT2A (0.32) LMNASMN1; SMN2TP53MAPTKCNH2
SCHEMBL11261972 0.87 TP53 (0.35) LMNASMN1; SMN2TP53MAPTHDAC6
SCHEMBL11262419 0.87 MEN1 (0.33) LMNASMN1; SMN2TP53MAPTBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4362738-A ANTIINFLAMMATORIES DR. KARL THOMAE GMBH (DE) 1982-12-07 — — US disclosed
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