SCHEMBL2947767

SCHEMBL2947767

CCCc1ccc(OC)c(-c2csc(NC(=O)NN3CCCN(C(=O)CCl)CC3)n2)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 12/20 0.44
MEN1 O00255 10/20 0.44
MAPT P10636 8/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
HTT P42858 1/20 0.44
KCNQ1 P51787 1/20 0.40
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
ALDH1A1 P00352 3/20 0.39
MAPK1 P28482 2/20 0.39
NPC1 O15118 1/20 0.38
ACHE P22303 1/20 0.38
LMNA P02545 3/20 0.38
USP2 O75604 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HPGD P15428 1/20 0.37

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
SCHEMBL2961877 0.88 KMT2A (0.45) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL2950908 0.88 KMT2A (0.45) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL2960279 0.85 KMT2A (0.38) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL2957637 0.83 KMT2A (0.45) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL2961641 0.81 KMT2A (0.45) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL2961585 0.81 ROCK1 (0.47) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL13198979 0.80 KMT2A (0.46) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL2959953 0.80 KMT2A (0.44) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL2953617 0.80 KMT2A (0.40) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL2955233 0.79 KMT2A (0.51) KMT2AMEN1MAPTSMN1; SMN2HTT

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
US-7767681-B2 2-Carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-08-03 US disclosed
US-7767674-B2 Kinase inhibitors ELI LILLY AND COMPANY (US) 2010-08-03 US disclosed
US-20080306068-A1 Suppression cytokines, tumor necrosis factor ELI LILLY AND COMPANY (US) 2008-12-11 US disclosed
US-20070179126-A1 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2007-08-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080306068-A1 Suppression cytokines, tumor necrosis factor TNF, TNFRSF1A, IL2 KMT2A 4340/4885MEN1 1734/4885MAPT 4665/4885
US-20070179126-A1 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof UGT2B7, PKD2, CYP2C19 KMT2A 1446/4885MEN1 990/4885MAPT 645/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.