SCHEMBL13665010

SCHEMBL13665010

CN1CCN(C(=O)[C@H]2CC[C@H](C(=O)Nc3c(C(=O)Nc4ccc(Cl)cn4)oc4ccccc34)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ MEN1 O00255 5/20 0.52
▸ KMT2A Q03164 5/20 0.52
▸ MAPT P10636 6/20 0.49
▸ HSD17B10 Q99714 4/20 0.49
▸ TSHR P16473 4/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ RXFP1 Q9HBX9 2/20 0.49
▸ HPGD P15428 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ GAA P10253 1/20 0.48
▸ LMNA P02545 1/20 0.47
▸ DHODH Q02127 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ TP53 P04637 2/20 0.47
▸ HTR2C P28335 1/20 0.47

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
SCHEMBL13664993 0.92 SMN1; SMN2 (0.56) SMN1; SMN2MEN1KMT2AMAPTHSD17B10
SCHEMBL13665002 0.92 SMN1; SMN2 (0.55) SMN1; SMN2MEN1KMT2AMAPTHSD17B10
SCHEMBL13665003 0.91 SMN1; SMN2 (0.54) SMN1; SMN2MEN1KMT2AMAPTHSD17B10
SCHEMBL13664994 0.91 SMN1; SMN2 (0.54) SMN1; SMN2MEN1KMT2AMAPTHSD17B10
SCHEMBL13665004 0.90 SMN1; SMN2 (0.50) SMN1; SMN2MEN1KMT2AMAPTHSD17B10
SCHEMBL13665000 0.90 SMN1; SMN2 (0.53) SMN1; SMN2MEN1KMT2AMAPTHSD17B10
SCHEMBL13290954 0.89 SMN1; SMN2 (0.46) SMN1; SMN2MEN1KMT2ATSHRKDM4E
SCHEMBL13665008 0.89 SMN1; SMN2 (0.52) SMN1; SMN2MEN1KMT2AMAPTHSD17B10
SCHEMBL13664999 0.88 SMN1; SMN2 (0.52) SMN1; SMN2MEN1KMT2AMAPTHSD17B10
SCHEMBL2949510 0.87 SMN1; SMN2 (0.58) SMN1; SMN2MEN1KMT2AMAPTHSD17B10

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-7605158-B2 Carbamoyl-type benzofuran derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-20 — — US disclosed
US-7605158-B2 Carbamoyl-type benzofuran derivatives MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-20 — — US disclosed
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