SCHEMBL3087950

SCHEMBL3087950

O=C(CCNC(=O)OCC1c2ccccc2-c2ccccc21)Oc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.58
▸ EPHX2 P34913 1/20 0.45
▸ CASP3 P42574 2/20 0.41
▸ FABP5 Q01469 2/20 0.39
▸ FABP7 O15540 1/20 0.39
▸ CXCR2 P25025 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
SCHEMBL888510 0.92 KMT2A (0.55) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL31387020 0.92 KMT2A (0.55) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL31310019 0.92 KMT2A (0.55) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL7855942 0.91 KMT2A (0.69) KMT2AEPHX2CASP3
SCHEMBL25390706 0.89 KMT2A (0.52) KMT2AEPHX2CASP3
SCHEMBL30748702 0.89 KMT2A (0.52) KMT2AEPHX2CASP3
SCHEMBL25391589 0.89 KMT2A (0.52) KMT2AEPHX2CASP3
SCHEMBL16942065 0.89 KMT2A (0.52) KMT2AEPHX2CASP3
SCHEMBL3060297 0.88 KMT2A (0.51) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL31733654 0.88 KMT2A (0.51) KMT2AEPHX2CASP3FABP5FABP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116829949-A Compositions for detecting or measuring analytes 伯蒂斯有限公司 2023-09-29 — — CN disclosed
EP-3225251-A1 MODULATION OF ACTIVITY OF PRONEUROTROPHINS H. Lundbeck A/S (DK) 2017-10-04 — — EP disclosed
EP-2120997-B1 MODULATION OF ACTIVITY OF PRONEUROTROPHINS H LUNDBECK AS (DK) 2017-03-01 — — EP disclosed
US-20160060346-A1 Modulation of Activity of Proneurotrophins H. LUNDBECK A/S (DK) 2016-03-03 — — US disclosed
US-9234036-B2 Modulation of activity of proneurotrophins H. LUNDBECK A/S (DK) 2016-01-12 — — US disclosed
US-20150023971-A1 Modulation of Activity of Proneurotrophins H LUNDBECK A/S (DK) 2015-01-22 — — US disclosed
US-8748384-B2 Modulation of activity of proneurotrophins H. LUNDBECK A/S (DK) 2014-06-10 — — US disclosed
US-7794734-B2 Mannheimia haemolytica chimeric outer membrane protein PlpE and leukotoxin epitopes as a vaccine or vaccine component against shipping fever THE BOARD OF REGENTS FOR OKLAHOMA STATE UNIVERSITY (US) 2010-09-14 — — US disclosed
US-20100210523-A1 MODULATION OF ACTIVITY OF PRONEUROTROPHINS NEURONICON APS (DK) 2010-08-19 — — US disclosed
EP-2120997-A2 MODULATION OF ACTIVITY OF PRONEUROTROPHINS H. Lundbeck A/S (DK) 2009-11-25 — — EP disclosed
WO-2008074329-A2 MODULATION OF ACTIVITY OF PRONEUROTROPHINS NEURONICON APS (DK) 2008-06-26 — — WO disclosed
US-20070134272-A1 Mannheimia haemolytica chimeric outer membrane protein PIpE and leukotoxin epitopes as a vaccine or vaccine component against shipping fever THE BOARD OF REGENTS FOR OKLAHOMA STATE UNIVERSITY 2007-06-14 — — US disclosed
US-7144580-B2 M. haemolytica outer membrane protein P1pE as a vaccine or vaccine component against shipping fever THE BOARD OF REGENTS FOR OKLAHOMA STATE UNIVERSITY (US) 2006-12-05 — — US disclosed
US-20060078572-A1 M. haemolytica outer membrane protein P1pE as a vaccine or vaccine component against shipping fever THE BOARD OF REGENTS FOR OKLAHOMA STATE UNIVERSITY 2006-04-13 — — US disclosed
US-20040156865-A1 M. haemolytica outer membrane protein P1pE as a vaccine or vaccine component against shipping fever THE BOARD OF REGENTS FOR OKLAHOMA STATE UNIVERSITY 2004-08-12 — — US 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 (3 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-20160060346-A1 Modulation of Activity of Proneurotrophins SORT1, BDNF, PRSS12 KMT2A 4659/4885EPHX2 4384/4885CASP3 3227/4885
US-20150023971-A1 Modulation of Activity of Proneurotrophins SORT1, OPRL1, BDNF KMT2A 4709/4885EPHX2 4429/4885CASP3 3547/4885
US-20100210523-A1 MODULATION OF ACTIVITY OF PRONEUROTROPHINS SORT1, BDNF, PRSS12 KMT2A 4659/4885EPHX2 4384/4885CASP3 3227/4885

“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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