SCHEMBL182053

SCHEMBL182053

C[C@@H](CN)C1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.56
TP53 P04637 1/20 0.52
KDM4E B2RXH2 1/20 0.50
GMNN O75496 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
SHBG P04278 1/20 0.44
ALDH1A1 P00352 1/20 0.42
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34

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
SCHEMBL28413106 1.00 EPHX1 (0.56) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL1394898 1.00 EPHX1 (0.56) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL20993755 1.00 EPHX1 (0.56) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL28427707 0.97
SCHEMBL5624085 0.97
SCHEMBL10079176 0.97
SCHEMBL936012 0.92
SCHEMBL1678475 0.86
Hydrochloric Acid SCHEMBL14744247 0.83
SCHEMBL23046648 0.83 EPHX1 (0.40) EPHX1TP53KDM4EGMNNLMNA

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
CN-111362809-B Chiral perovskite nanosheet, and preparation method and application thereof 国家纳米科学中心 2023-03-31 CN claimed
CN-111362809-A Chiral perovskite nanosheet, and preparation method and application thereof 国家纳米科学中心 2020-07-03 CN claimed
CN-111362809-B Chiral perovskite nanosheet, and preparation method and application thereof 国家纳米科学中心 2023-03-31 CN disclosed
CN-111362809-A Chiral perovskite nanosheet, and preparation method and application thereof 国家纳米科学中心 2020-07-03 CN disclosed
EP-1735286-B1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2012-01-04 EP disclosed
CN-1956964-B Tetrahydro-indazole cannabinoid modulators JANSSEN PHARMACEUTICA NV 2011-06-15 CN disclosed
US-20090099143-A1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS LAGU BHARAT 2009-04-16 US disclosed
US-7452997-B2 Tetrahydro-indazole cannabinoid modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2008-11-18 US disclosed
CN-1956964-A Tetrahydro-indazole cannabinoid modulators JANSSEN PHARMACEUTICA NV (BE) 2007-05-02 CN disclosed
US-20050228034-A1 Tetrahydro-indazole cannabinoid modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2005-10-13 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-20050228034-A1 Tetrahydro-indazole cannabinoid modulators CNR2, CNR1, GPR18 EPHX1 969/4885TP53 4869/4885KDM4E 1714/4885
US-20090099143-A1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS CNR2, CNR1, GPR18 EPHX1 969/4885TP53 4869/4885KDM4E 1714/4885

“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.