SCHEMBL6477427

SCHEMBL6477427

CSc1ncc(CN)cn1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 5/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
RECQL P46063 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
LOX P28300 2/20 0.31
LMNA P02545 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRR1 P24046 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
HSP90AA1 P07900 1/20 0.31
ADRB2 P07550 1/20 0.30
LOXL3 P58215 1/20 0.30
HASPIN Q8TF76 1/20 0.30

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
Hydrochloric Acid SCHEMBL6526925 0.98 KDM4E (0.33) LOXL2KDM4EMAPTRECQLMEN1
SCHEMBL9908382 0.78 CA12 (0.37) KDM4EMAPTRECQLMEN1KMT2A
SCHEMBL4378015 0.76 MEN1 (0.36) KDM4EMAPTRECQLMEN1KMT2A
SCHEMBL485902 0.76 LMNA (0.37) KDM4EMAPTRECQLMEN1KMT2A
SCHEMBL2222860 0.76 LMNA (0.34) KDM4EMAPTRECQLMEN1KMT2A
Hydrochloric Acid SCHEMBL22468715 0.74 MEN1 (0.35) KDM4EMAPTRECQLMEN1KMT2A
SCHEMBL7996444 0.74 MC4R (0.38) RECQLMEN1KMT2A
SCHEMBL6599401 0.73 KDM4E (0.38) KDM4EMAPTRECQLMEN1KMT2A
SCHEMBL20857359 0.73 ESR1 (0.35) KDM4EMAPTRECQLMEN1KMT2A
SCHEMBL14451743 0.73 LMNA (0.38) KDM4EMAPTRECQLMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6900319-B2 Thrombin inhibitors ABBOTT GMBH & CO. KG (DE) 2005-05-31 US disclosed
US-20020169318-A1 Novel thrombin inhibitors ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2002-11-14 US disclosed
US-6444817-B1 ANTICOAGULANTS ABBOTT LABORATORIES 2002-09-03 US disclosed
US-6030972-A 2- OR 5-AMINOMETHYL,2- OR 5-CYANOPYRIMIDINES AS INTERMEDIATES OF ANTICOAGULANTS IN EXTRACORPOREAL CIRCULATION (HEART-LUNG MACHINE, HEMODIALYSIS) BASF AKTIENGESELLSCHAFT (DE) 2000-02-29 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 (1 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-20020169318-A1 Novel thrombin inhibitors TFPI, SERPINC1, F11 LOXL2 3222/4885KDM4E 4081/4885MAPT 4816/4885

“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.