SCHEMBL9701664

SCHEMBL9701664

CCc1cc(N(C=O)c2ccccc2)cc(CC)c1N/C(=N/C(C)(C)C)SC

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL9701670 1.00 LMNA (0.31) LMNACYP3A4CYP2D6MAPTCYP2C9
SCHEMBL9700587 0.76 ALDH1A1 (0.40) LMNACYP3A4CYP2D6MAPTCYP2C9
SCHEMBL9700892 0.71 GABRA1 (0.32)
SCHEMBL9700902 0.68 POLB (0.36) LMNACYP3A4CYP2D6MAPTCYP2C9
SCHEMBL9701957 0.65 ALDH1A1 (0.33)
SCHEMBL9700700 0.65 GABRA1 (0.51)
SCHEMBL5516786 0.61 ALDH1A1 (0.42) LMNACYP3A4CYP2D6MAPTCYP2C9
SCHEMBL43388 0.61 ALDH1A1 (0.42) LMNACYP3A4CYP2D6MAPTCYP2C9
SCHEMBL1487730 0.60 TSPO (0.41) LMNAHTTNPSR1MEN1KMT2A
SCHEMBL3725404 0.60 ALDH1A1 (0.42) HTTNPSR1MEN1KMT2A

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-5114975-A Insecticides and miticides CIBA-GEIGY CORPORATION (US) 1992-05-19 US disclosed
US-5026730-A Anilinophenylthioureas, compositions containing them, and the use thereof in pest control CIBA-GEIGY CORPORATION (US) 1991-06-25 US disclosed