SCHEMBL1298146

SCHEMBL1298146

CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C=C(\C)CC/C=C(\C)CCC=C(C)CN

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.77
SQLE Q14534 8/20 0.74
MAPT P10636 2/20 0.61
MEN1 O00255 2/20 0.61
CYP3A4 P08684 2/20 0.61
ALOX15 P16050 2/20 0.61
ALDH1A1 P00352 1/20 0.61
UGT1A1 P22309 1/20 0.61
KDM4E B2RXH2 1/20 0.55
POLB P06746 1/20 0.50

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
Squalene SCHEMBL28621919 0.88 KMT2A (0.81) KMT2ASQLEMAPTMEN1CYP3A4
Squalene SCHEMBL28621917 0.88 KMT2A (0.81) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL8013144 0.88 KMT2A (1.00) KMT2ASQLEMAPTMEN1CYP3A4
Squalene SCHEMBL890053 0.88 KMT2A (1.00) KMT2ASQLEMAPTMEN1CYP3A4
Squalene SCHEMBL2799805 0.88 KMT2A (1.00) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL23802597 0.88 KMT2A (1.00) KMT2ASQLEMAPTMEN1CYP3A4
Squalene SCHEMBL8819997 0.88 KMT2A (1.00) KMT2ASQLEMAPTMEN1CYP3A4
Squalene SCHEMBL21823197 0.88 KMT2A (1.00) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL21639794 0.88 KMT2A (1.00) KMT2ASQLEMAPTMEN1CYP3A4
SCHEMBL39067 0.88 KMT2A (1.00) KMT2ASQLEMAPTMEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110664757-B Nanocrystalline eye drop, preparation method and application thereof 成都瑞沐生物医药科技有限公司 2022-08-02 CN disclosed
US-10874740-B2 5-ALA derivatives and use thereof UNIVERSITE DE GENEVE (CH) 2020-12-29 US disclosed
EP-3297675-B1 5-ALA DERIVATIVES UNIV GENEVE (CH) 2020-07-08 EP disclosed
CN-110664757-A Nanocrystalline eye drop, preparation method and application thereof 成都瑞沐生物医药科技有限公司 2020-01-10 CN disclosed
US-20190240329-A1 5-ALA DERIVATIVES AND USE THEREOF UNIVERSITE DE GENEVE (CH) 2019-08-08 US disclosed
US-10258690-B2 5-ALA derivatives and use thereof UNIVERSITE DE GENEVE (CH) 2019-04-16 US disclosed
US-20180133320-A1 5-ALA DERIVATIVES AND USE THEREOF UNIVERSITE DE GENEVE (CH) 2018-05-17 US disclosed
EP-3297675-A1 5-ALA DERIVATIVES AND USE THEREOF Université de Genève (CH) 2018-03-28 EP disclosed
WO-2016185368-A1 5-ALA DERIVATIVES AND USE THEREOF UNIVERSITE DE GENEVE (CH) 2016-11-24 WO disclosed
EP-3095464-A1 5-ALA DERIVATIVES AND USE THEREOF UNIVERSITE DE GENEVE (CH) 2016-11-23 EP disclosed
US-8962552-B2 Nanoparticles of therapeutic agents having low water solubility CENTRE NATIONALE DE RECHERCHE SCIENTIFIQUE (FR) 2015-02-24 US disclosed
US-20110269731-A1 NANOPARTICLES OF BETA-LACTAM DERIVATIVES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2011-11-03 US disclosed
US-20100305030-A1 NANOPARTICLES OF THERAPEUTIC AGENTS HAVING LOW WATER SOLUBILITY CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-12-02 US disclosed
CN-1512890-A HCG formulation 开米卡公司 2004-07-14 CN 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-20190240329-A1 5-ALA DERIVATIVES AND USE THEREOF ALAD, ANXA5, AAAS KMT2A 2690/4885SQLE 396/4885MAPT 3634/4885
US-20180133320-A1 5-ALA DERIVATIVES AND USE THEREOF ALAD, ANXA5, AAAS KMT2A 2690/4885SQLE 396/4885MAPT 3634/4885
US-10874740-B2 5-ALA derivatives and use thereof ALAD, ANXA5, AAAS KMT2A 2690/4885SQLE 396/4885MAPT 3634/4885
US-20110269731-A1 NANOPARTICLES OF BETA-LACTAM DERIVATIVES BACE1, BBOX1, PTMS KMT2A 466/4885SQLE 1001/4885MAPT 897/4885
US-20100305030-A1 NANOPARTICLES OF THERAPEUTIC AGENTS HAVING LOW WATER SOLUBILITY AQP1, CD44, AQP3 KMT2A 2067/4885SQLE 10/4885MAPT 579/4885
US-10258690-B2 5-ALA derivatives and use thereof ALAD, ANXA5, AAAS KMT2A 2690/4885SQLE 396/4885MAPT 3634/4885

“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.