SCHEMBL5441998

SCHEMBL5441998

Brc1ccc(SCCN2CCOCC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.56
KMT2A Q03164 4/20 0.54
MEN1 O00255 2/20 0.54
TSHR P16473 2/20 0.54
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
MPI P34949 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.47
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL11534923 0.90 POLB (0.65) POLBKMT2AMEN1TSHRKDM4E
SCHEMBL4265997 0.84 LTA4H (0.61) KMT2AMEN1KDM4EALDH1A1LMNA
SCHEMBL11536207 0.83 POLB (0.56) POLBKDM4E
SCHEMBL11529719 0.83 POLB (0.78) POLBKMT2AKDM4ELMNASMN1; SMN2
SCHEMBL11478965 0.83 POLB (0.56) POLBKMT2AMEN1KDM4EALDH1A1
SCHEMBL11539203 0.83 MEN1 (0.66) POLBKMT2AMEN1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL11529713 0.82 POLB (0.81) POLBKMT2AMEN1KDM4ELMNA
SCHEMBL19153326 0.81 MAPT (0.49) KMT2AMEN1KDM4EALDH1A1MAPT
Hydrochloric Acid SCHEMBL11534952 0.81 MEN1 (0.69) POLBKMT2AMEN1KDM4EALDH1A1
SCHEMBL11537141 0.81 POLB (0.57) POLBKMT2AMEN1TSHRKDM4E

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-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 US disclosed
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 US disclosed
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 US disclosed
WO-2007056075-A2 SIX MEMBERED HETEROAROMATIC INHIBITORS TARGETING RESISTANT KINASE MUTATIONS TARGEGEN, INC. (US) 2007-05-18 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 (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-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations ABL1, KDR, BCR POLB 1755/4885KMT2A 141/4885MEN1 1745/4885

“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.