SCHEMBL18941467

SCHEMBL18941467

NCCCCC(Nc1ccc([N+](=O)[O-])cc1)C(=O)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDF Q9HBH1 1/20 0.48
▸ SSTR3 P32745 1/20 0.44
▸ MMP2 P08253 2/20 0.43
▸ MAPT P10636 6/20 0.43
▸ CRHBP P24387 1/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ MGLL Q99685 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ MYOC Q99972 1/20 0.42
▸ BCL9 O00512 1/20 0.41
▸ CTNNB1 P35222 1/20 0.41
▸ PKM P14618 1/20 0.40

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
SCHEMBL18941468 1.00 PDF (0.48) PDFSSTR3MMP2MAPTCRHBP
SCHEMBL8740500 0.81 MMP2 (0.53) PDFMMP2MAPTCRHBPCRHR2
SCHEMBL2387943 0.81 MMP2 (0.53) PDFMMP2MAPTCRHBPCRHR2
SCHEMBL4423862 0.81 MMP2 (0.53) PDFMMP2MAPTCRHBPCRHR2
SCHEMBL10866363 0.80 MAPT (0.49) PDFSSTR3MMP2MAPTCRHBP
SCHEMBL19209361 0.80 HTR2A (0.55) PDFSSTR3MAPTALDH1A1KMT2A
SCHEMBL30544863 0.79 TGM2 (0.50) PDFSSTR3MMP2MAPTCRHBP
SCHEMBL16494584 0.79 HDAC1 (0.55) SSTR3
SCHEMBL648254 0.79 HDAC1 (0.55) SSTR3
Hydrochloric Acid SCHEMBL28627653 0.78 HDAC1 (0.54) SSTR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210069381-A1 METHODS AND SYSTEMS FOR STIFFENING OF TISSUE FOR IMPROVED PROCESSING LIFECELL CORPORATION 2021-03-11 — — US disclosed
US-10850008-B2 Methods and systems for stiffening of tissue for improved processing LIFECELL CORPORATION (US) 2020-12-01 — — US disclosed
US-20170165402-A1 METHODS AND SYSTEMS FOR STIFFENING OF TISSUE FOR IMPROVED PROCESSING LIFECELL CORPORATION 2017-06-15 — — US disclosed
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