SCHEMBL4696347

SCHEMBL4696347

Cc1cc(=O)oc2cc(NC(=O)Cc3ccccc3)ccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 1.00
TDP1 Q9NUW8 2/20 0.77
ALDH1A1 P00352 9/20 0.71
KDM4E B2RXH2 8/20 0.71
HPGD P15428 6/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
GLA P06280 1/20 0.70
GAA P10253 1/20 0.70
KMT2A Q03164 3/20 0.67
MEN1 O00255 2/20 0.67
HSD17B10 Q99714 2/20 0.67
CA12 O43570 3/20 0.64
CA9 Q16790 3/20 0.64
CA1 P00915 1/20 0.64
POLB P06746 1/20 0.63
NPC1 O15118 2/20 0.61
MAPT P10636 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
LMNA P02545 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61

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
SCHEMBL16800347 0.88 RAB9A (0.79) RAB9ATDP1ALDH1A1KDM4EHPGD
SCHEMBL11231059 0.83 KDM4E (0.74) RAB9ATDP1ALDH1A1KDM4EHPGD
SCHEMBL29435302 0.83 KDM4E (0.74) RAB9ATDP1ALDH1A1KDM4EHPGD
SCHEMBL12986344 0.83 KDM4E (0.74) RAB9ATDP1ALDH1A1KDM4EHPGD
SCHEMBL8513693 0.83 CA12 (0.81) RAB9ATDP1ALDH1A1KDM4EHPGD
SCHEMBL18741340 0.82 KDM4E (1.00) RAB9ATDP1ALDH1A1KDM4EHPGD
SCHEMBL5675501 0.82 KDM4E (0.77) RAB9ATDP1ALDH1A1KDM4EHPGD
SCHEMBL3081887 0.82 RAB9A (0.70) RAB9ATDP1ALDH1A1KDM4EHPGD
SCHEMBL790969 0.82 KDM4E (0.73) RAB9ATDP1ALDH1A1KDM4EHPGD
SCHEMBL29435304 0.82 KDM4E (0.81) RAB9ATDP1ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3160517-B1 WATER-SOLUBLE ACTIVATABLE MOLECULAR PROBES, INTERMEDIATES FOR THE SYNTHESIS THEREOF AND ASSOCIATED DETECTION METHODS ECOLE NORMALE SUPERIEURE LYON (FR) 2024-06-12 EP disclosed
CN-106470977-B Water-soluble activatable molecular probe, synthetic intermediate thereof and related detection method 里昂高等师范学院 2021-07-09 CN disclosed
US-10179929-B2 Water-soluble activatable molecular probes, intermediates for the synthesis thereof and associated detection methods ECOLE NORMALE SUPERIEURE DE LYON (FR) 2019-01-15 US disclosed
US-10179929-B2 Water-soluble activatable molecular probes, intermediates for the synthesis thereof and associated detection methods ECOLE NORMALE SUPERIEURE DE LYON (FR) 2019-01-15 US disclosed
US-20170159100-A1 WATER-SOLUBLE ACTIVATABLE MOLECULAR PROBES, INTERMEDIATES FOR THE SYNTHESIS THEREOF AND ASSOCIATED DETECTION METHODS ECOLE NORMALE SUPERIEURE DE LYON (FR) 2017-06-08 US disclosed
US-20170159100-A1 WATER-SOLUBLE ACTIVATABLE MOLECULAR PROBES, INTERMEDIATES FOR THE SYNTHESIS THEREOF AND ASSOCIATED DETECTION METHODS ECOLE NORMALE SUPERIEURE DE LYON (FR) 2017-06-08 US disclosed
CN-106470977-A Water solublity can anakmetomeres probe, its synthetic intermediate and related detecting method 里昂高等师范学院 2017-03-01 CN disclosed
US-8754179-B2 Light activated shape memory co-polymers CORNERSTONE RESEARCH GROUP, INC. (US) 2014-06-17 US disclosed
US-20080021166-A1 Light Activated Shape Memory Co-Polymers GOVERNMENT OF THE UNITED STATES AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2008-01-24 US disclosed
EP-1799771-A2 LIGHT ACTIVATED SHAPE MEMORY CO-POLYMERS CORNERSTONE RESEARCH GROUP, INC. (US) 2007-06-27 EP disclosed
WO-2007001407-A2 LIGHT ACTIVATED SHAPE MEMORY CO-POLYMERS CORNERSTONE RESEARCH GROUP, INC. (US) 2007-01-04 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 (2 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-10179929-B2 Water-soluble activatable molecular probes, intermediates for the synthesis thereof and associated detection methods SI, GUSB, ABCG2 RAB9A 4525/4885TDP1 2102/4885ALDH1A1 426/4885
US-20170159100-A1 WATER-SOLUBLE ACTIVATABLE MOLECULAR PROBES, INTERMEDIATES FOR THE SYNTHESIS THEREOF AND ASSOCIATED DETECTION METHODS SI, GUSB, ABCG2 RAB9A 4525/4885TDP1 2102/4885ALDH1A1 426/4885

“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.