SCHEMBL645855

SCHEMBL645855

Cc1ccnc(-c2ccccn2)c1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.49
KDM6B O15054 1/20 0.49
KDM4A O75164 1/20 0.49
KDM5C P41229 1/20 0.49
KDM4C Q9H3R0 1/20 0.49
KDM2A Q9Y2K7 1/20 0.49
KDM3A Q9Y4C1 1/20 0.49
NPC1 O15118 1/20 0.47
LMNA P02545 2/20 0.46
P4HTM Q9NXG6 2/20 0.46
NAPRT Q6XQN6 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KMT2A Q03164 2/20 0.46
PIN1 Q13526 1/20 0.42
CYP1A2 P05177 1/20 0.41
POLB P06746 1/20 0.41
CCR1 P32246 1/20 0.41
CCR5 P51681 1/20 0.41
CCR8 P51685 1/20 0.41
METAP1 P53582 1/20 0.41

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
SCHEMBL5838644 0.86 KDM4E (0.46) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL87737 0.82 KDM4E (0.50) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL5532401 0.81 DHODH (0.49) LMNAP4HTMNAPRTL3MBTL1KMT2A
SCHEMBL28556199 0.81 KDM4E (0.49) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL8952364 0.81 KDM4E (0.49) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL30447581 0.81 CCR1 (0.50) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL31663481 0.81 KDM4E (0.49) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL29364955 0.77 KDM4E (0.49) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL15238291 0.77 KDM4E (0.49) KDM4EKDM6BKDM4AKDM5CKDM4C
SCHEMBL29693997 0.76 KDM4E (0.44) KDM4EKDM6BKDM4AKDM5CKDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120208190-A1 LUMINESCENT METAL ION COMPLEXES BIOSEARCH TECHNOLOGIES, INC. (US) 2012-08-16 US disclosed
US-8119781-B2 Luminescent metal ion complexes BIOSEARCH TECHNOLOGIES, INC. (US) 2012-02-21 US disclosed
US-20100130733-A1 LUMINESCENT METAL ION COMPLEXES BIOSEARCH TECHNOLOGIES, INC. (US) 2010-05-27 US disclosed
US-7635762-B2 Luminescent metal ion complexes BIOSEARCH TECHNOLOGIES, INC. (US) 2009-12-22 US disclosed
US-20040146895-A1 Luminescent metal ion complexes BIOSEARCH TECHNOLOGIES, INC. 2004-07-29 US disclosed
WO-2004037907-A2 LUMINESCENT METAL ION COMPLEXES BIOSEARCH TECHNOLOGIES, INC. (US) 2004-05-06 WO disclosed
WO-2003003009-A1 USE OF METAL-ION CHELATES IN VALIDATING BIOLOGICAL MOLECULES AS DRUG TARGETS IN TEST ANIMAL MODELS 7TM PHARMA A/S (DK) 2003-01-09 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 (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-20040146895-A1 Luminescent metal ion complexes SLC30A6, SLC39A14, SLC39A3 KDM4E 3429/4885KDM6B 3791/4885KDM4A 3432/4885
US-20100130733-A1 LUMINESCENT METAL ION COMPLEXES SLC30A6, SLC39A14, SLC39A3 KDM4E 3429/4885KDM6B 3791/4885KDM4A 3432/4885
US-20120208190-A1 LUMINESCENT METAL ION COMPLEXES SLC30A6, SLC39A14, SLC39A3 KDM4E 3429/4885KDM6B 3791/4885KDM4A 3432/4885

“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.