SCHEMBL13310858

SCHEMBL13310858

CC/N=c1/ccc2c(-c3ccccc3C(=O)OCC)c3cc(C)c(NCC)cc3oc-2c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.41
▸ USP2 O75604 2/20 0.40
▸ CFTR P13569 1/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ GOPC Q9HD26 1/20 0.40
▸ RAB9A P51151 2/20 0.35
▸ MAPT P10636 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ MAPK10 P53779 1/20 0.35
▸ PTK2B Q14289 1/20 0.35
▸ NCOA1 Q15788 1/20 0.35
▸ NCOA3 Q9Y6Q9 1/20 0.35
▸ ALDH1A1 P00352 4/20 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
SCHEMBL16521972 0.90 FTO (0.41) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL10028465 0.88 ABCB1 (0.38) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL4817749 0.88 ABCB1 (0.38) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL1495836 0.88 ABCB1 (0.38) ABCB1USP2CFTRPAX8ATM
SCHEMBL6056007 0.88 ABCB1 (0.47) ABCB1USP2CFTRPAX8ATM
SCHEMBL13653629 0.88 ABCB1 (0.47) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL23064834 0.87 USP2 (0.38) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL58076 0.87 USP2 (0.38) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL23064835 0.87 USP2 (0.38) ABCB1USP2CFTRPAX8ATM
Rhodamine 6G SCHEMBL5403477 0.87 USP2 (0.38) ABCB1USP2CFTRPAX8ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11802211-B2 Polymeric dyes and uses thereof BECTON, DICKINSON AND COMPANY (US) 2023-10-31 — — US disclosed
US-11802211-B2 Polymeric dyes and uses thereof BECTON, DICKINSON AND COMPANY (US) 2023-10-31 — — US disclosed
US-20210355379-A1 LIGHT-EMITTING PARTICLE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2021-11-18 — — US disclosed
US-20210230428-A1 POLYMERIC DYES AND USES THEREOF BECTON DICKINSON CO (US) 2021-07-29 — — US disclosed
US-20140336303-A1 Optical Element for Correcting Color Blindness NITTO DENKO CORPORATION (JP) 2014-11-13 — — US disclosed
US-20140336303-A1 Optical Element for Correcting Color Blindness NITTO DENKO CORPORATION (JP) 2014-11-13 — — US disclosed
US-7731762-B2 Dye composition and dyeing method FUJIFILM CORPORATION (JP) 2010-06-08 — — US disclosed
US-20090184047-A1 Functionalized nanopore membranes and related methods of use NATIONAL SCIENCE FOUNDATION 2009-07-23 — — US disclosed
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