SCHEMBL307102

SCHEMBL307102

CCCCCCCCCCN(CCO)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
FABP5 Q01469 3/20 0.39
FABP7 O15540 2/20 0.39
TLR2 O60603 5/20 0.39
EPHX2 P34913 1/20 0.38
EYA2 O00167 1/20 0.37
CCR6 P51684 1/20 0.37
PAX8 Q06710 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
SCHEMBL17108591 0.89 KMT2A (0.44) KMT2AFABP5FABP7TLR2EPHX2
SCHEMBL20371103 0.89 KMT2A (0.48) KMT2AFABP5FABP7EPHX2
SCHEMBL3792078 0.88 KMT2A (0.54) KMT2AFABP5FABP7TLR2EPHX2
SCHEMBL28416919 0.87 KMT2A (0.40) KMT2AFABP5FABP7TLR2EPHX2
SCHEMBL31040664 0.87 KMT2A (0.46) KMT2AFABP5FABP7TLR2
SCHEMBL28414420 0.87 KMT2A (0.46) KMT2AFABP5FABP7TLR2
SCHEMBL21838102 0.87 KMT2A (0.46) KMT2AFABP5FABP7TLR2
SCHEMBL30861809 0.87 KMT2A (0.46) KMT2AFABP5FABP7TLR2
SCHEMBL307644 0.86 KMT2A (0.41) KMT2AFABP5FABP7TLR2EPHX2
SCHEMBL29883728 0.86 KMT2A (0.41) KMT2AFABP5FABP7TLR2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112592940-B Biological enzyme synthesis method of N- (9-fluorenylmethoxycarbonyl) -decylaminoacetaldehyde 江西邦泰绿色生物合成生态产业园发展有限公司 2023-05-02 CN claimed
CN-112592940-B Biological enzyme synthesis method of N- (9-fluorenylmethoxycarbonyl) -decylaminoacetaldehyde 江西邦泰绿色生物合成生态产业园发展有限公司 2023-05-02 CN disclosed
CN-111233713-A Synthesis method of telavancin intermediate 福建康鸿生物科技有限公司 2020-06-05 CN disclosed
US-20190153036-A1 VANCOMYCIN DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2019-05-23 US disclosed
US-8859506-B2 Glycopeptide phosphonate derivatives THERAVANCE BIOPHARMA ANTIBIOTICS IP, LLC (US) 2014-10-14 US disclosed
US-20140024604-A1 GLYCOPEPTIDE PHOSPHONATE DERIVATIVES THERAVANCE, INC. (US) 2014-01-23 US disclosed
US-8541375-B2 Glycopeptide phosphonate derivatives THERAVANCE, INC. (US) 2013-09-24 US disclosed
US-20120283195-A1 GLYCOPEPTIDE PHOSPHONATE DERIVATIVES THERAVANCE, INC. (US) 2012-11-08 US disclosed
US-8101575-B2 Glycopeptide phosphonate derivatives THERAVANCE, INC. (US) 2012-01-24 US disclosed
US-8093354-B2 Process for preparing glycopeptide phosphonate derivatives THERAVANCE, INC. (US) 2012-01-10 US disclosed
US-20030045457-A1 Process for preparing glycopeptide derivatives CUMBERLAND PHARMACEUTICALS INC. 2003-03-06 US disclosed
US-20030008812-A1 Glycopeptide derivatives THERAVANCE, INC. 2003-01-09 US disclosed
US-6455669-B1 GLYCOPROTEIN FOR USE IN THE TREATMENT AND PREVENTION OF BACTERIAL INFECTIONS THERAVANCE, INC. 2002-09-24 US disclosed
US-6444786-B1 BACTERICIDES ADVANCED MEDICINE, INC. 2002-09-03 US disclosed
US-6392012-B1 COMPOUND FOR USE IN TREATMENT AND PREVENTION OF BACTERIAL INFECTION ADVANCED MEDICINE, INC. 2002-05-21 US disclosed
US-20020022590-A1 Useful as antibiotics; reduced tissue accumulation and/or nephrotoxicity when administered to a mammal; useful against vancomycin-resistant microorganisms CUMBERLAND PHARMACEUTICALS INC. 2002-02-21 US disclosed
WO-2001098328-A2 GLYCOPEPTIDE PHOSPHONATE DERIVATIVES THERAVANCE, INC. (US) 2001-12-27 WO disclosed
EP-1140993-A1 GLYCOPEPTIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Advanced Medicine, Inc. (US) 2001-10-10 EP disclosed
WO-2001057071-A2 GLYCOPEPTIDE DERIVATIVES HAVING ANTIBIOTIC ACTIVITY ADVANCED MEDICINE, INC. (US) 2001-08-09 WO disclosed
WO-2000039156-A1 GLYCOPEPTIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME ADVANCED MEDICINE, INC. (US) 2000-07-06 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 (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-20140024604-A1 GLYCOPEPTIDE PHOSPHONATE DERIVATIVES PAG1, PGLS, PTMS KMT2A 4796/4885FABP5 2120/4885FABP7 3340/4885
US-20030045457-A1 Process for preparing glycopeptide derivatives GYPA, VIP, OGT KMT2A 4121/4885FABP5 3659/4885FABP7 4012/4885
US-20030008812-A1 Glycopeptide derivatives MGAT3, GYPA, GIPR KMT2A 4608/4885FABP5 2718/4885FABP7 3062/4885
US-20120283195-A1 GLYCOPEPTIDE PHOSPHONATE DERIVATIVES PAG1, PGLS, PTMS KMT2A 4796/4885FABP5 2120/4885FABP7 3340/4885
US-20190153036-A1 VANCOMYCIN DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF PEPD, VIP, NRDC KMT2A 4210/4885FABP5 3581/4885FABP7 4170/4885
US-20020022590-A1 Useful as antibiotics; reduced tissue accumulation and/or nephrotoxicity when administered to a mammal; useful against vancomycin-resistant microorganisms GLS, PIGS, PAG1 KMT2A 4773/4885FABP5 1107/4885FABP7 563/4885

“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.