SCHEMBL79107

SCHEMBL79107

COc1cccc(/C=c2\[nH]c(=O)/c(=C/c3ncoc3C(C)(C)C)[nH]c2=O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SERPINE1 P05121 1/20 0.45
▸ CYP1A2 P05177 2/20 0.45
▸ CYP2C9 P11712 2/20 0.45
▸ CYP2C19 P33261 2/20 0.45
▸ RAF1 P04049 1/20 0.45
▸ CDK1 P06493 1/20 0.45
▸ CCNB1 P14635 1/20 0.45
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ CYP2D6 P10635 1/20 0.39
▸ PIM1 P11309 2/20 0.39
▸ AKR1B1 P15121 1/20 0.39
▸ PIM2 Q9P1W9 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ GAA P10253 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ EGFR P00533 1/20 0.37

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
SCHEMBL87290 1.00 SERPINE1 (0.45) SERPINE1CYP1A2CYP2C9CYP2C19RAF1
SCHEMBL79478 0.90 CYP1A2 (0.43) SERPINE1CYP1A2CYP2C9CYP2C19RAF1
SCHEMBL79694 0.90 CYP1A2 (0.48) SERPINE1CYP1A2CYP2C9CYP2C19RAF1
SCHEMBL87420 0.90 CYP1A2 (0.43) SERPINE1CYP1A2CYP2C9CYP2C19RAF1
SCHEMBL79702 0.89 CYP1A2 (0.40) SERPINE1CYP1A2CYP2C9CYP2C19RAF1
SCHEMBL87443 0.89 CYP1A2 (0.40) SERPINE1CYP1A2CYP2C9CYP2C19RAF1
SCHEMBL79647 0.89 CYP1A2 (0.43) SERPINE1CYP1A2CYP2C9CYP2C19RAF1
SCHEMBL87273 0.89 CYP1A2 (0.43) SERPINE1CYP1A2CYP2C9CYP2C19RAF1
SCHEMBL11986035 0.89 CYP1A2 (0.43) SERPINE1CYP1A2CYP2C9CYP2C19RAF1
SCHEMBL91422 0.87 CYP1A2 (0.46) SERPINE1CYP1A2CYP2C9CYP2C19RAF1

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11633393-B2 Tubulin binding compounds and therapeutic use thereof BEYONDSPRING PHARMACEUTICALS, INC. (US) 2023-04-25 — — US disclosed
US-20200237754-A1 TUBULIN BINDING COMPOUNDS AND THERAPEUTIC USE THEREOF BEYONDSPRING PHARMACEUTICALS, INC. 2020-07-30 — — US disclosed
US-8618292-B2 Analogs of dehydrophenylahistins and their therapeutic use BEYONDSPRING PHARMACEUTICALS, INC. (US) 2013-12-31 — — US disclosed
US-20120277251-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THERAPEUTIC USE NEREUS PHARMACEUTICALS, INC. (US) 2012-11-01 — — US disclosed
US-20120277251-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THERAPEUTIC USE NEREUS PHARMACEUTICALS, INC. (US) 2012-11-01 — — US disclosed
US-20120277251-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THERAPEUTIC USE NEREUS PHARMACEUTICALS, INC. (US) 2012-11-01 — — US disclosed
US-8247552-B2 Analogs of dehydrophenylahistins and their therapeutic use NEREUS PHARMACEUTICALS, INC. (US) 2012-08-21 — — US disclosed
US-8247552-B2 Analogs of dehydrophenylahistins and their therapeutic use NEREUS PHARMACEUTICALS, INC. (US) 2012-08-21 — — US disclosed
US-8247552-B2 Analogs of dehydrophenylahistins and their therapeutic use NEREUS PHARMACEUTICALS, INC. (US) 2012-08-21 — — US disclosed
US-8129527-B2 cancer and non-cancer diseases associated with vascular proliferation; mitoxantrone resistant, taxol resistant cancers NEREUS PHARMACUTICALS, INC. (US) 2012-03-06 — — US disclosed
US-7919497-B2 Analogs of dehydrophenylahistins and their therapeutic use NEREUS PHARMACEUTICALS, INC. (US) 2011-04-05 — — US disclosed
US-7919497-B2 Analogs of dehydrophenylahistins and their therapeutic use NEREUS PHARMACEUTICALS, INC. (US) 2011-04-05 — — US disclosed
US-20080221122-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THEAPEUTIC USE BEYONDSPRING PHARMACEUTICALS, INC. 2008-09-11 — — US disclosed
US-20080221122-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THEAPEUTIC USE BEYONDSPRING PHARMACEUTICALS, INC. 2008-09-11 — — US disclosed
US-20080221122-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THEAPEUTIC USE BEYONDSPRING PHARMACEUTICALS, INC. 2008-09-11 — — US disclosed
EP-1926724-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THERAPEUTIC USE Nereus Pharmaceuticals, Inc. (US) 2008-06-04 — — EP disclosed
US-20070078138-A1 Analogs of dehydrophenylahistins and their therapeutic use BEYONDSPRING PHARMACEUTICALS, INC. 2007-04-05 — — US disclosed
US-20070078138-A1 Analogs of dehydrophenylahistins and their therapeutic use BEYONDSPRING PHARMACEUTICALS, INC. 2007-04-05 — — US disclosed
US-20070078138-A1 Analogs of dehydrophenylahistins and their therapeutic use BEYONDSPRING PHARMACEUTICALS, INC. 2007-04-05 — — US disclosed
WO-2007035841-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THERAPEUTIC USE NEREUS PHARMACEUTICALS, INC. (US) 2007-03-29 — — 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 (5 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-20070078138-A1 Analogs of dehydrophenylahistins and their therapeutic use MKI67, HPGDS, HCCS SERPINE1 754/4885CYP1A2 2042/4885CYP2C9 4257/4885
US-20080221122-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THEAPEUTIC USE HPGDS, DHPS, HCCS SERPINE1 597/4885CYP1A2 1594/4885CYP2C9 3869/4885
US-11633393-B2 Tubulin binding compounds and therapeutic use thereof TUBB6, TUBB1, TUBB SERPINE1 3816/4885CYP1A2 4665/4885CYP2C9 4752/4885
US-20200237754-A1 TUBULIN BINDING COMPOUNDS AND THERAPEUTIC USE THEREOF TUBB6, TUBB1, TUBB SERPINE1 3816/4885CYP1A2 4665/4885CYP2C9 4752/4885
US-20120277251-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THERAPEUTIC USE MKI67, HPGDS, HCCS SERPINE1 754/4885CYP1A2 2042/4885CYP2C9 4257/4885

“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.

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