SCHEMBL2957612

SCHEMBL2957612

O=C1C=CC(=O)c2c1ccc1cc3ccccc3cc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.64
▸ MEN1 O00255 2/20 0.64
▸ USP2 O75604 2/20 0.64
▸ TP53 P04637 2/20 0.64
▸ HPGD P15428 2/20 0.64
▸ MAPK1 P28482 2/20 0.64
▸ KMT2A Q03164 2/20 0.64
▸ HIF1A Q16665 2/20 0.64
▸ LMNA P02545 1/20 0.64
▸ CYP1A2 P05177 1/20 0.64
▸ CYP2D6 P10635 1/20 0.64
▸ CYP2C9 P11712 1/20 0.64
▸ ALOX12 P18054 1/20 0.64
▸ CYP2C19 P33261 1/20 0.64
▸ NQO1 P15559 1/20 0.53
▸ CDC25A P30304 6/20 0.47
▸ CDC25C P30307 6/20 0.47
▸ ARSA P15289 1/20 0.47
▸ IDO1 P14902 3/20 0.41
▸ CDC25B P30305 3/20 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
SCHEMBL29447251 1.00 ALDH1A1 (0.64) ALDH1A1MEN1USP2TP53HPGD
SCHEMBL33372528 0.82 ALDH1A1 (0.82) ALDH1A1MEN1USP2TP53HPGD
SCHEMBL64776 0.82 ALDH1A1 (0.82) ALDH1A1MEN1USP2TP53HPGD
SCHEMBL893374 0.78 ALDH1A1 (1.00) ALDH1A1MEN1USP2TP53HPGD
SCHEMBL30702421 0.78 ALDH1A1 (1.00) ALDH1A1MEN1USP2TP53HPGD
Anthracene SCHEMBL11125352 0.75 CDC25B (0.74) ALDH1A1MEN1USP2TP53HPGD
SCHEMBL7213583 0.75 CES1 (0.72) ALDH1A1MEN1USP2TP53HPGD
SCHEMBL1270918 0.74 ALOX15 (0.41) ALDH1A1MEN1USP2TP53HPGD
SCHEMBL87570 0.74 CES1 (0.70) ALDH1A1MEN1USP2TP53HPGD
SCHEMBL7654790 0.73 CDC25B (0.55) ALDH1A1MEN1USP2TP53HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220213524-A1 KINASE SCREENING ASSAYS THE UNIVERSITY OF NEWCASTLE UPON TYNE (GB) 2022-07-07 — — US claimed
EP-3966344-A1 KINASE SCREENING ASSAYS University of Newcastle Upon Tyne (GB) 2022-03-16 — — EP disclosed
US-8298830-B2 Organic materials able to detect analytes MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-10-30 — — US disclosed
US-20100310424-A1 ORGANIC MATERIALS ABLE TO DETECT ANALYTES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2010-12-09 — — US disclosed
US-7759127-B2 Organic materials able to detect analytes MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2010-07-20 — — US disclosed
US-7700366-B2 Fluorescent, semi-conductive polymers, and devices comprising them MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2010-04-20 — — US disclosed
EP-1313785-B1 COMPOSITION COMPRISING IPTYCENE POLYMERS WITH HIGH INTERNAL VOLUME MASSACHUSETTS INST TECHNOLOGY (US) 2009-04-01 — — EP disclosed
US-7494698-B2 Polymers with high internal free volume MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2009-02-24 — — US disclosed
US-20080188634-A1 Polymers with high internal free volume MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2008-08-07 — — US disclosed
US-20060073607-A1 Organic materials able to detect analytes MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2006-04-06 — — US disclosed
US-20050196775-A1 Fluorescent, semi-conductive polymers, and devices comprising them MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2005-09-08 — — US disclosed
WO-2005073338-A2 FLUORESCENT, SEMI-CONDUCTIVE POLYMERS, AND DEVICES COMPRISING THEM MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2005-08-11 — — WO disclosed
US-20040170775-A1 Polymers with high internal free volume MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2004-09-02 — — US disclosed
US-6783814-B2 GRAFT POLYMER OF POROUS POLYMER AND INTERPENETRATING POLYMER NETWORK MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2004-08-31 — — US disclosed
EP-1313785-A2 POLYMERS WITH HIGH INTERNAL FREE VOLUME MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2003-05-28 — — EP disclosed
WO-2002016463-A9 POLYMERS WITH HIGH INTERNAL FREE VOLUME MASSACHUSETTS INST TECHNOLOGY (US) 2003-04-03 — — WO disclosed
US-20020150697-A1 Polymers with high internal free volume NAVY, SECRETARY OF THE, UNITED STATES OF AMERICA 2002-10-17 — — US disclosed
WO-2002016463-A2 POLYMERS WITH HIGH INTERNAL FREE VOLUME MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2002-02-28 — — WO disclosed
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