SCHEMBL2227674

SCHEMBL2227674

CN1CCNCC1C1CC[N]CC1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 5/20 0.32
CHRNB4 P30926 5/20 0.32
CHRNA3 P32297 5/20 0.32
CHRNA4 P43681 5/20 0.32
HTR2C P28335 1/20 0.30

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
SCHEMBL2918468 0.86 HTR2C (0.34) HTR2C
Hydrochloric Acid SCHEMBL27851765 0.84 HTR2C (0.33) HTR2C
SCHEMBL11968900 0.82 GNAI3 (0.36) CHRNB2CHRNB4CHRNA3CHRNA4HTR2C
SCHEMBL508981 0.81 HTR2C (0.39) HTR2C
SCHEMBL23719656 0.76 GNAI3 (0.37) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL29869645 0.76 GNAI3 (0.37) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL21581542 0.76 GNAI3 (0.37) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL20758573 0.76 GNAI3 (0.37) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL10259483 0.76 GNAI3 (0.37) CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL24672102 0.76 GNAI3 (0.37) CHRNB2CHRNB4CHRNA3CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9168245-B2 Selective protein kinase inhibitors AB SCIENCE (FR) 2015-10-27 US claimed
EP-2736904-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS SELECTIVE PROTEIN KINASE INHIBITORS (C-KIT) AB Science (FR) 2014-06-04 EP claimed
WO-2013014170-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS SELECTIVE PROTEIN KINASE INHIBITORS (C-KIT) AB SCIENCE (FR) 2013-01-31 WO claimed
US-10053455-B2 Diazaspiroalkaneone-substituted oxazole derivatives as spleen tyrosine kinase inhibitors AB SCIENCE (FR) 2018-08-21 US disclosed
EP-3122744-A1 DIAZASPIROALKANEONE-SUBSTITUTED OXAZOLE DERIVATIVES AS SPLEEN TYROSINE KINASE INHIBITORS AB Science (FR) 2017-02-01 EP disclosed
WO-2016124747-A1 COMPOUNDS WITH ANTI-TUMORAL ACTIVITY AB SCIENCE (FR) 2016-08-11 WO disclosed
EP-3010906-A1 BENZIMIDAZOLE DERIVATIVES AS SELECTIVE PROTEINE KINASE INHIBITORS AB Science (FR) 2016-04-27 EP disclosed
WO-2015144614-A1 DIAZASPIROALKANEONE-SUBSTITUTED OXAZOLE DERIVATIVES AS SPLEEN TYROSINE KINASE INHIBITORS AB SCIENCE (FR) 2015-10-01 WO disclosed
EP-2523952-B1 OXAZOLE KINASE INHIBITORS AB SCIENCE (FR) 2015-03-04 EP disclosed
WO-2014202763-A1 BENZIMIDAZOLE DERIVATIVES AS SELECTIVE PROTEINE KINASE INHIBITORS AB SCIENCE (FR) 2014-12-24 WO disclosed
EP-2736904-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS SELECTIVE PROTEIN KINASE INHIBITORS (C-KIT) AB Science (FR) 2014-06-04 EP disclosed
WO-2013014170-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS SELECTIVE PROTEIN KINASE INHIBITORS (C-KIT) AB SCIENCE (FR) 2013-01-31 WO disclosed
EP-2523952-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS AB Science (FR) 2012-11-21 EP disclosed
WO-2011086085-A1 THIAZOLE AND OXAZOLE KINASE INHIBITORS AB SCIENCE (FR) 2011-07-21 WO disclosed
EP-1960372-A1 KINASE INHIBITORS AND THEIR USES Rigel Pharmaceuticals, Inc. (US) 2008-08-27 EP disclosed
WO-2007070872-A1 KINASE INHIBITORS AND THEIR USES RIGEL PHARMACEUTICALS, INC. (US) 2007-06-21 WO 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-10053455-B2 Diazaspiroalkaneone-substituted oxazole derivatives as spleen tyrosine kinase inhibitors SYK, ZAP70, LCK CHRNB2 2857/4885CHRNB4 3126/4885CHRNA3 3112/4885

“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.