SCHEMBL3915564

SCHEMBL3915564

Cc1ccc(Cn2cncc(Br)c2=O)cc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
NPBWR1 P48145 1/20 0.39
SCD O00767 1/20 0.39
CYP11B1 P15538 5/20 0.38
CYP11B2 P19099 5/20 0.38
CYP19A1 P11511 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPK10 P53779 2/20 0.36
USP2 O75604 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
IDO1 P14902 1/20 0.36
FSCN1 Q16658 1/20 0.35
QPCT Q16769 2/20 0.35
MAPT P10636 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL3916349 0.88 PDPK1 (0.40)
SCHEMBL3911396 0.84 TP53 (0.53) LMNAHTTCYP11B1CYP11B2CYP19A1
SCHEMBL3921773 0.80 SMN1; SMN2 (0.50) LMNAHTTSCDCYP11B1CYP11B2
SCHEMBL3111412 0.79 CYP11B1 (0.51) LMNAHTTCYP11B1CYP11B2CYP19A1
SCHEMBL3914923 0.78 CYP11B1 (0.54) LMNAHTTCYP11B1CYP11B2CYP19A1
SCHEMBL3912721 0.77 CYP11B1 (0.54) LMNACYP11B1CYP11B2IDO1
SCHEMBL2400441 0.77 CYP11B2 (0.56) LMNANPBWR1CYP11B1CYP11B2IDO1
SCHEMBL3913086 0.77 ABCC8 (0.49) HTTCYP11B1CYP11B2CYP19A1MEN1
SCHEMBL3914606 0.77 GRM2 (0.44) LMNAHTTSCDCYP11B1CYP11B2
SCHEMBL3921634 0.76 EGLN1 (0.53) LMNAHTTCYP11B1CYP11B2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE GAUDINO JOHN 2011-03-03 US disclosed
EP-2032538-A2 QUINOLINE COMPOUNDS AND METHODS OF USE Array Biopharma, Inc. (US) 2009-03-11 EP disclosed
WO-2007146824-A2 QUINOLINE COMPOUNDS AND METHODS OF USE ARRAY BIOPHARMA INC. (US) 2007-12-21 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-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE TK1, ABL1, ROR1 LMNA 1139/4885HTT 3456/4885NPBWR1 1521/4885

“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.