SCHEMBL60897

SCHEMBL60897

CCCNC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.48
GRIN3B O60391 1/20 0.48
GRIN1 Q05586 1/20 0.48
GRIN2A Q12879 1/20 0.48
GRIN2B Q13224 1/20 0.48
GRIN2C Q14957 1/20 0.48
GRIN3A Q8TCU5 1/20 0.48
EPHX2 P34913 9/20 0.45
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
CNR2 P34972 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL11922812 0.86 EPHX2 (0.49) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Hydrochloric Acid SCHEMBL1677567 0.86 GRIN2D (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL3188537 0.85 GRIN2D (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Hydrochloric Acid SCHEMBL1677960 0.85 EPHX2 (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4562108 0.85 EPHX2 (0.56) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1567819 0.83 EPHX2 (0.58) EPHX2CNR2
SCHEMBL1149892 0.83 EPHX2 (0.58) EPHX2CNR2
Hydrochloric Acid SCHEMBL1677599 0.81 EPHX2 (0.57) EPHX2CNR2
SCHEMBL1082075 0.80 EPHX2 (0.50) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL1548214 0.80 GRIN2D (0.54) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4107198-B1 POLYISOCYANATE PREPARATIONS COVESTRO DEUTSCHLAND AG (DE) 2024-03-13 EP disclosed
EP-3560975-B2 IONICALLY HYDROPHILIZED POLYISOCYANATES AND ANTIOXIDANTS COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2023-12-06 EP disclosed
EP-3724251-B2 IONICALLY HYDROPHILIZED POLYISOCYANATES, WATER CONTENT COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2023-11-22 EP disclosed
US-20230364030-A1 PARENTERAL TREATMENTS INVOLVING AMINOADAMANTANE DERIVATIVES SHINKEI THERAPEUTICS, INC. (US) 2023-11-16 US disclosed
US-11707439-B2 Parenteral treatments involving aminoadamantane derivatives SHINKEI THERAPEUTICS, INC. (US) 2023-07-25 US disclosed
EP-3851472-B1 IONICALLY HYDROPHILIZED POLYISOCYANATES, WATER CONTENT COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2023-06-07 EP disclosed
US-20200315991-A1 PARENTERAL TREATMENTS INVOLVING AMINOADAMANTANE DERIVATIVES SHINKEI THERAPEUTICS, INC. 2020-10-08 US disclosed
US-8129519-B2 Derivatives of fluorene, anthracene, xanthene, dibenzosuberone and acridine and uses thereof ALLERGAN SALES, LLC 2012-03-06 US disclosed
US-20100137354-A1 DERIVATIVES OF FLUORENE, ANTHRACENE, XANTHENE, DIBENZOSUBERONE AND ACRIDINE AND USES THEREOF ALLERGAN SALES, LLC 2010-06-03 US disclosed
EP-1889832-A2 Oxypentafluorosulfate compositions and processes for making them Air Products and Chemicals, Inc. (US) 2008-02-20 EP 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 (1 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-20100137354-A1 DERIVATIVES OF FLUORENE, ANTHRACENE, XANTHENE, DIBENZOSUBERONE AND ACRIDINE AND USES THEREOF WNT1, CTNND1, CTNNB1 GRIN2D 4626/4885GRIN3B 4785/4885GRIN1 4826/4885

“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.