SCHEMBL1171595

SCHEMBL1171595

COc1ccc(-c2ccc(-c3cn(-c4ccc(-c5ccc(OC)cc5)cc4)c4ccc(-c5ccc(OC)cc5)cc34)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 2/20 0.52
ESR1 P03372 1/20 0.49
ESR2 Q92731 1/20 0.49
PTPN11 Q06124 10/20 0.47
KDM1A O60341 2/20 0.47
KDR P35968 1/20 0.47
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
ALOX12 P18054 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 1/20 0.41
PKM P14618 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
SCHEMBL18552151 0.94 KDR (0.52) ESRRAESR1ESR2PTPN11KDM1A
SCHEMBL18552051 0.89 KDR (0.50) ESRRAPTPN11KDM1AKDRHPGD
SCHEMBL18552150 0.86 BRD4 (0.46) PTPN11KDM1AKDRMAPTPKM
SCHEMBL18552136 0.86 KDR (0.47) ESRRAPTPN11KDM1AKDRMAPT
SCHEMBL18552052 0.82 ABL1 (0.44) PTPN11KDM1AKDR
SCHEMBL18552222 0.81 ESR1 (0.46) ESRRAESR1ESR2
SCHEMBL18552156 0.81 ESR1 (0.46) ESRRAESR1ESR2
SCHEMBL18551977 0.81 ESR1 (0.46) ESRRAESR1ESR2
SCHEMBL18552033 0.79 ESR1 (0.42) ESRRAESR1ESR2MAPT
SCHEMBL18552223 0.78 DYRK1A (0.49) ESRRAESR1ESR2KDR

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-20210002270-A1 TRICYCLIC SPACER SYSTEMS FOR NONLINEAR OPTICAL DEVICES LIGHTWAVE LOGIC, INC. 2021-01-07 US disclosed
US-20180044333-A1 Tricyclic Spacer Systems for Nonlinear Optical Devices GOETZ JENNIFER (US) 2018-02-15 US disclosed
US-20170204091-A1 TRICYCLIC SPACER SYSTEMS FOR NONLINEAR DEVICES LIGHTWAVE LOGIC INC (US) 2017-07-20 US disclosed
US-20140121376-A1 TRICYCLIC SPACER SYSTEMS FOR NONLINEAR OPTICAL DEVICES LIGHTWAVE LOGIC, INC. (US) 2014-05-01 US disclosed
US-8298326-B2 Tricyclic spacer systems for nonlinear optical devices GOETZ SR FREDERICK J (US) 2012-10-30 US disclosed
US-20110112295-A1 TRICYCLIC SPACER SYSTEMS FOR NONLINEAR OPTICAL DEVICES Lightwave Logic Inc. (US) 2011-05-12 US disclosed
US-7894695-B2 Tricyclic spacer systems for nonlinear optical devices LIGHTWAVE LOGIC, INC. 2011-02-22 US disclosed
US-20080009620-A1 Tricyclic Spacer Systems For Nonlinear Optical Devices THIRD-ORDER NANOTECHNOLOGIES, INC. (US) 2008-01-10 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 (6 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-20080009620-A1 Tricyclic Spacer Systems For Nonlinear Optical Devices AQP4, CCND3, CDK14 ESRRA 2869/4885ESR1 925/4885ESR2 2663/4885
US-20140121376-A1 TRICYCLIC SPACER SYSTEMS FOR NONLINEAR OPTICAL DEVICES AQP4, CCND3, CDK14 ESRRA 2869/4885ESR1 925/4885ESR2 2663/4885
US-20170204091-A1 TRICYCLIC SPACER SYSTEMS FOR NONLINEAR DEVICES CCND3, CCNY, CCND2 ESRRA 2145/4885ESR1 729/4885ESR2 2379/4885
US-20110112295-A1 TRICYCLIC SPACER SYSTEMS FOR NONLINEAR OPTICAL DEVICES AQP4, CCND3, CDK14 ESRRA 2869/4885ESR1 925/4885ESR2 2663/4885
US-20210002270-A1 TRICYCLIC SPACER SYSTEMS FOR NONLINEAR OPTICAL DEVICES AQP4, CCND3, CDK14 ESRRA 2869/4885ESR1 925/4885ESR2 2663/4885
US-20180044333-A1 Tricyclic Spacer Systems for Nonlinear Optical Devices AQP4, CCND3, CDK14 ESRRA 2869/4885ESR1 925/4885ESR2 2663/4885

“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.