SCHEMBL1079200

SCHEMBL1079200

Nc1ccc(C[C@H]2CN(CC(=O)O)CCN(CC(=O)O)CCN2CC(=O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.45
CHIT1 Q13231 2/20 0.38
DPP4 P27487 2/20 0.38
S1PR1 P21453 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
CA1 P00915 4/20 0.35
CA2 P00918 4/20 0.35
CA4 P22748 4/20 0.35
CA9 Q16790 4/20 0.35
SLC6A9 P48067 1/20 0.35

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
SCHEMBL5864632 1.00 FOLH1 (0.45) FOLH1CHIT1DPP4S1PR1DPP7
SCHEMBL1996255 1.00 FOLH1 (0.45) FOLH1CHIT1DPP4S1PR1DPP7
SCHEMBL15904929 1.00 FOLH1 (0.45) FOLH1CHIT1DPP4S1PR1DPP7
SCHEMBL17119211 1.00 FOLH1 (0.45) FOLH1CHIT1DPP4S1PR1DPP7
Hydrochloric Acid SCHEMBL31226505 0.99 FOLH1 (0.44) FOLH1CHIT1DPP4S1PR1DPP7
SCHEMBL436094 0.94 LMNA (0.45) FOLH1CHIT1DPP4S1PR1CA1
SCHEMBL23627788 0.93 HSD17B10 (0.44) FOLH1CHIT1DPP4
SCHEMBL12974377 0.93 FOLH1 (0.41) FOLH1CHIT1DPP4SIGMAR1
SCHEMBL4098689 0.93 HSD17B10 (0.44) FOLH1CHIT1DPP4
SCHEMBL12261650 0.93 FOLH1 (0.41) FOLH1CHIT1DPP4S1PR1SLC6A9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9809624-B2 Neurotensin analogues for radioisotope targeting to neurotensin receptor-positive tumors INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2017-11-07 US claimed
EP-2702388-B1 SAMPLE CONTAINERS ADAPTED FOR ACOUSTIC EJECTIONS AND SAMPLE PRESERVATION AND METHODS THEREOF LABCYTE INC (US) 2021-08-04 EP disclosed
US-20180304251-A1 SAMPLE CONTAINERS ADAPTED FOR ACOUSTIC EJECTIONS AND SAMPLE PRESERVATION AND METHODS THEREOF LABCYTE INC. 2018-10-25 US disclosed
US-10016757-B2 Sample containers adapted for acoustic ejections and sample preservation and methods thereof LABCYTE INC. (US) 2018-07-10 US disclosed
US-9809624-B2 Neurotensin analogues for radioisotope targeting to neurotensin receptor-positive tumors INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2017-11-07 US disclosed
EP-2454272-B1 NEUROTENSIN ANALOGUES FOR RADIOISOTOPE TARGETING TO NEUROTENSIN RECEPTOR-POSITIVE TUMORS IASON GMBH (AT) 2017-08-23 EP disclosed
EP-2702388-A1 SAMPLE CONTAINERS ADAPTED FOR ACOUSTIC EJECTIONS AND SAMPLE PRESERVATION AND METHODS THEREOF Labcyte Inc. (US) 2014-03-05 EP disclosed
US-20130109042-A1 SAMPLE CONTAINERS ADAPTED FOR ACOUSTIC EJECTIONS AND SAMPLE PRESERVATION AND METHODS THEREOF LABCYTE INC. (US) 2013-05-02 US disclosed
WO-2012149314-A1 SAMPLE CONTAINERS ADAPTED FOR ACOUSTIC EJECTIONS AND SAMPLE PRESERVATION AND METHODS THEREOF LABCYTE INC. (US) 2012-11-01 WO disclosed
US-20120207676-A1 NEUROTENSIN ANALOGUES FOR RADIOISOTOPE TARGETING TO NEUROTENSIN RECEPTOR-POSITIVE TUMORS INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2012-08-16 US disclosed
EP-2454272-A1 NEUROTENSIN ANALOGUES FOR RADIOISOTOPE TARGETING TO NEUROTENSIN RECEPTOR-POSITIVE TUMORS INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2012-05-23 EP disclosed
WO-2011006985-A1 NEUROTENSIN ANALOGUES FOR RADIOISOTOPE TARGETING TO NEUROTENSIN RECEPTOR-POSITIVE TUMORS INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2011-01-20 WO disclosed