SCHEMBL3156282

SCHEMBL3156282

N#Cc1cnc2ccccc2c1CBr

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.50
MAP2K1 Q02750 3/20 0.44
RAF1 P04049 2/20 0.44
KDM4E B2RXH2 5/20 0.39
GPR3 P46089 1/20 0.39
ALDH1A1 P00352 4/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 2/20 0.35
GLA P06280 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
EGFR P00533 2/20 0.34
ERBB2 P04626 2/20 0.34
IMPDH2 P12268 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34

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
SCHEMBL4572184 0.83 LRRK2 (0.54) LRRK2MAP2K1RAF1KDM4EGPR3
SCHEMBL4231806 0.83 LRRK2 (0.50) LRRK2MAP2K1RAF1KDM4EGPR3
SCHEMBL27668262 0.80 LRRK2 (0.57) LRRK2MAP2K1RAF1KDM4EGPR3
SCHEMBL4063577 0.77 LRRK2 (0.48) LRRK2MAP2K1RAF1EGFRERBB2
SCHEMBL7010214 0.76 LRRK2 (0.44) LRRK2MAP2K1RAF1KDM4EGPR3
SCHEMBL27668508 0.76 TLR7 (0.47) LRRK2MAP2K1RAF1KDM4EALDH1A1
SCHEMBL1164857 0.74 LRRK2 (0.54) LRRK2MAP2K1RAF1KDM4EGPR3
SCHEMBL1346465 0.74 LRRK2 (0.54) LRRK2MAP2K1RAF1KDM4EGPR3
SCHEMBL3152060 0.74 KDM4E (0.42) KDM4EGPR3ALDH1A1POLBMAPT
SCHEMBL1344423 0.74 LRRK2 (0.54) LRRK2MAP2K1RAF1KDM4EGPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2233493-A1 Macrolides Pfizer Products Inc. (US) 2010-09-29 EP disclosed
EP-1836211-B1 MACROLIDES PFIZER PROD INC (US) 2010-03-03 EP disclosed
US-7462600-B2 Macrolides PFIZER INC (US) 2008-12-09 US disclosed
EP-1836211-A1 MACROLIDES Pfizer Products Incorporated (US) 2007-09-26 EP disclosed
WO-2006067589-A1 MACROLIDES PFIZER PRODUCTS INC. (US) 2006-06-29 WO disclosed
US-20060135447-A1 Macrolides CHUPAK LOUIS S 2006-06-22 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-20060135447-A1 Macrolides LCAT, NOP2, HDAC6 LRRK2 3765/4885MAP2K1 4791/4885RAF1 4146/4885

“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.