SCHEMBL10993874

SCHEMBL10993874

N=C(Cl)c1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.56
▸ TSHR P16473 3/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ L3MBTL1 Q9Y468 2/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ ATM Q13315 1/20 0.55
▸ CES2 O00748 3/20 0.50
▸ CES1 P23141 3/20 0.50
▸ ALOX15 P16050 1/20 0.48
▸ CYP2A6 P11509 1/20 0.47
▸ CA1 P00915 2/20 0.46
▸ CA2 P00918 2/20 0.46
▸ GSK3B P49841 2/20 0.42
▸ SRD5A2 P31213 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ PHGDH O43175 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ MGLL Q99685 1/20 0.39

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
SCHEMBL10605179 0.79 LMNA (0.59) LMNATSHRMAPK1L3MBTL1CYP3A4
SCHEMBL18657400 0.79 LMNA (0.59) LMNATSHRMAPK1L3MBTL1CYP3A4
SCHEMBL29733438 0.77 LMNA (0.56) LMNATSHRMAPK1L3MBTL1CYP3A4
SCHEMBL7671018 0.77 LMNA (0.56) LMNATSHRMAPK1L3MBTL1CYP3A4
SCHEMBL11143129 0.75 TSHR (0.60) LMNATSHRMAPK1L3MBTL1CYP3A4
SCHEMBL10628497 0.75 TSHR (0.60) LMNATSHRMAPK1L3MBTL1CYP3A4
SCHEMBL10756203 0.74 LMNA (0.54) LMNATSHRMAPK1L3MBTL1CYP3A4
SCHEMBL1219593 0.74 LMNA (0.95) LMNAALDH1A1HPGDHSD17B10
SCHEMBL10991644 0.74 ALDH1A1 (0.48) LMNAATMCES2CES1GSK3B
SCHEMBL8296748 0.74 LMNA (0.54) LMNATSHRMAPK1L3MBTL1CYP3A4

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-4528382-A Imidoyl substituted pyrroles MCNEILAB, INC. (US) 1985-07-09 — — US disclosed
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